Structure of 3-Phenylpropanamide (C9H11NO)
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Chemical Formula | C9H11NO |
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Molecular Weight | 149.18974 g/mol |
IUPAC Name | 3-phenylpropanamide |
SMILES String | NC(=O)CCc1ccccc1 |
InChI | InChI=1S/C9H11NO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,10,11) |
InChIKey | VYIBCOSBNVFEIW-UHFFFAOYSA-N |
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Chemical Structure Description
A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 3-Phenylpropanamide molecule contains a total of 22 bond(s). There are 11 non-H bond(s), 7 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 primary amide(s) (aliphatic). Images of the chemical structure of 3-Phenylpropanamide are given below:
The 2D chemical structure image of 3-Phenylpropanamide is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 3-Phenylpropanamide are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.
The 3D chemical structure image of 3-Phenylpropanamide is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of 3-Phenylpropanamide. Download structure data file (SDF/MOL) file of this compound.
Interactive 3D Visualization
For a better understanding of the chemical structure, an interactive 3D visualization of 3-Phenylpropanamide is provided here.
The 3-Phenylpropanamide molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the 3-Phenylpropanamide molecule can be increased or decreased by scrolling the mouse wheel.
The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of 3-Phenylpropanamide can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.
Search Another Chemical Structure
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Input example for Ethanol:
- Name: ethanol
- CAS #: 64-17-5
- Formula: C2H5OH
- Smiles: CCO
- InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Additional Information for Identifying 3-Phenylpropanamide Molecule
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SMILES (Simplified Molecular-Input Line-Entry System) string of 3-Phenylpropanamide
The SMILES string of 3-Phenylpropanamide is NC(=O)CCc1ccccc1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the 3-Phenylpropanamide.
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Structure Data File (SDF/MOL File) of 3-Phenylpropanamide
The structure data file (SDF/MOL File) of 3-Phenylpropanamide is available for download in the SDF page of 3-Phenylpropanamide, which provides the information about the atoms, bonds, connectivity and coordinates of 3-Phenylpropanamide. The 3-Phenylpropanamide structure data file can be imported to most of the cheminformatics software systems and applications.
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Chemical formula of 3-Phenylpropanamide
The molecular formula of 3-Phenylpropanamide is available in chemical formula page of 3-Phenylpropanamide, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.
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Molecular weight of 3-Phenylpropanamide
The molecular weight of 3-Phenylpropanamide is available in molecular weight page of 3-Phenylpropanamide, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.
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Other names (synonyms) or registry numbers of 3-Phenylpropanamide
The 3-Phenylpropanamide compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 3-Phenylpropanamide including the various registry numbers, if available:
- T6441035
- C-36448
- BBV-38773084
- Z33546514
- J-000837
- I01-6564
- ETHYL, 2-AMINO-2-OXO-1-(PHENYLMETHYL)-
- A800649
- M-3210
- EN300-45094
- P1845
- P790
- MFCD00025535
- ANW-14763
- PROPIONAMIDE, G-PHENYL
- Benzenepropanamide (9CI)
- 3-(phenyl)propionamide
- .beta.-Phenylpropionamide
- Amide hydrocinnamique [French]
- Amide hydrocinnamique
- beta-Phenylpropionamide
- Benzenepropanamide
- HYDROCINNAMAMIDE
- 3-Phenyl-propionamide
- 102-93-2
- 3-Phenylpropionamide
3-Phenylpropanamide Identification Summary Frequently Asked Questions (FAQs)
What’s the chemical formula of 3-Phenylpropanamide? |
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C9H11NO |
How many atoms and what are the elements included the 3-Phenylpropanamide molecule? |
22 atom(s) - 11 Hydrogen atom(s), 9 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s) |
How many chemical bonds and what kind of bonds are included the 3-Phenylpropanamide structure? |
22 bond(s) - 11 non-H bond(s), 7 multiple bond(s), 3 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 1 primary amide(s) (aliphatic) |
What’s the 3-Phenylpropanamide’s molecular weight? |
149.18974 g/mol |
What’s the SMILES code of 3-Phenylpropanamide? |
NC(=O)CCc1ccccc1 |
What’s the InChI string of 3-Phenylpropanamide? |
InChI=1S/C9H11NO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,10,11) |
What’s the InChIKey code of 3-Phenylpropanamide? |
VYIBCOSBNVFEIW-UHFFFAOYSA-N |