About N-(2-chlorophenyl)-3-phenylmethoxybenzamide
N-(2-chlorophenyl)-3-phenylmethoxybenzamide (PubChem CID 807381) has the molecular formula C20H16ClNO2
and a molecular weight of 337.81 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-phenylmethoxybenzamide.
Molecular Properties
| Compound Name | N-(2-chlorophenyl)-3-phenylmethoxybenzamide |
| PubChem CID | 807381 |
| Molecular Formula | C20H16ClNO2 |
| Molecular Weight | 337.81 g/mol |
| Exact Mass | 337.09 |
| IUPAC Name | N-(2-chlorophenyl)-3-phenylmethoxybenzamide |
| SMILES | O=C(Nc1ccccc1Cl)c1cccc(OCc2ccccc2)c1 |
| InChI | InChI=1S/C20H16ClNO2/c21-18-11-4-5-12-19(18)22-20(23)16-9-6-10-17(13-16)24-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,22,23) |
| InChIKey | KAJHZLJTHIKGND-UHFFFAOYSA-N |
| XLogP | 5.17 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 337.81 |
| LogP ≤ 5 | 5.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-chlorophenyl)-3-phenylmethoxybenzamide?
The IUPAC name of N-(2-chlorophenyl)-3-phenylmethoxybenzamide (CID 807381) is N-(2-chlorophenyl)-3-phenylmethoxybenzamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-phenylmethoxybenzamide?
The canonical SMILES for N-(2-chlorophenyl)-3-phenylmethoxybenzamide is O=C(Nc1ccccc1Cl)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-(2-chlorophenyl)-3-phenylmethoxybenzamide?
The InChIKey is KAJHZLJTHIKGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClNO2/c21-18-11-4-5-12-19(18)22-20(23)16-9-6-10-17(13-16)24-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,22,23).
What are the key properties of N-(2-chlorophenyl)-3-phenylmethoxybenzamide?
N-(2-chlorophenyl)-3-phenylmethoxybenzamide has a molecular weight of 337.81 g/mol, XLogP of 5.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-phenylmethoxybenzamide is sourced from PubChem (CID 807381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).