About N-(2-acetylphenyl)-4-methoxybenzamide
N-(2-acetylphenyl)-4-methoxybenzamide (PubChem CID 3509429) has the molecular formula C16H15NO3
and a molecular weight of 269.30 g/mol. Its IUPAC name is N-(2-acetylphenyl)-4-methoxybenzamide.
Molecular Properties
| Compound Name | N-(2-acetylphenyl)-4-methoxybenzamide |
| PubChem CID | 3509429 |
| Molecular Formula | C16H15NO3 |
| Molecular Weight | 269.30 g/mol |
| Exact Mass | 269.11 |
| IUPAC Name | N-(2-acetylphenyl)-4-methoxybenzamide |
| SMILES | COc1ccc(C(=O)Nc2ccccc2C(C)=O)cc1 |
| InChI | InChI=1S/C16H15NO3/c1-11(18)14-5-3-4-6-15(14)17-16(19)12-7-9-13(20-2)10-8-12/h3-10H,1-2H3,(H,17,19) |
| InChIKey | WHYBHFRCALKVMS-UHFFFAOYSA-N |
| XLogP | 3.15 |
| TPSA | 55.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 269.30 |
| LogP ≤ 5 | 3.15 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-acetylphenyl)-4-methoxybenzamide?
The IUPAC name of N-(2-acetylphenyl)-4-methoxybenzamide (CID 3509429) is N-(2-acetylphenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(2-acetylphenyl)-4-methoxybenzamide?
The canonical SMILES for N-(2-acetylphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccccc2C(C)=O)cc1.
What is the InChIKey of N-(2-acetylphenyl)-4-methoxybenzamide?
The InChIKey is WHYBHFRCALKVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-11(18)14-5-3-4-6-15(14)17-16(19)12-7-9-13(20-2)10-8-12/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-(2-acetylphenyl)-4-methoxybenzamide?
N-(2-acetylphenyl)-4-methoxybenzamide has a molecular weight of 269.30 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-4-methoxybenzamide is sourced from PubChem (CID 3509429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).