About N-(4-ethylphenyl)benzamide
N-(4-ethylphenyl)benzamide (PubChem CID 774063) has the molecular formula C15H15NO
and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(4-ethylphenyl)benzamide.
Molecular Properties
| Compound Name | N-(4-ethylphenyl)benzamide |
| PubChem CID | 774063 |
| Molecular Formula | C15H15NO |
| Molecular Weight | 225.29 g/mol |
| Exact Mass | 225.12 |
| IUPAC Name | N-(4-ethylphenyl)benzamide |
| SMILES | CCc1ccc(NC(=O)c2ccccc2)cc1 |
| InChI | InChI=1S/C15H15NO/c1-2-12-8-10-14(11-9-12)16-15(17)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,16,17) |
| InChIKey | PVTYITKMIHHRJH-UHFFFAOYSA-N |
| XLogP | 3.50 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.29 |
| LogP ≤ 5 | 3.50 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-ethylphenyl)benzamide?
The IUPAC name of N-(4-ethylphenyl)benzamide (CID 774063) is N-(4-ethylphenyl)benzamide.
What is the SMILES notation for N-(4-ethylphenyl)benzamide?
The canonical SMILES for N-(4-ethylphenyl)benzamide is CCc1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)benzamide?
The InChIKey is PVTYITKMIHHRJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-2-12-8-10-14(11-9-12)16-15(17)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,16,17).
What are the key properties of N-(4-ethylphenyl)benzamide?
N-(4-ethylphenyl)benzamide has a molecular weight of 225.29 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)benzamide is sourced from PubChem (CID 774063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).