About 4-methoxy-3-phenoxy-N-phenylbenzamide
4-methoxy-3-phenoxy-N-phenylbenzamide (PubChem CID 18626251) has the molecular formula C20H17NO3
and a molecular weight of 319.36 g/mol. Its IUPAC name is 4-methoxy-3-phenoxy-N-phenylbenzamide.
Molecular Properties
| Compound Name | 4-methoxy-3-phenoxy-N-phenylbenzamide |
| PubChem CID | 18626251 |
| Molecular Formula | C20H17NO3 |
| Molecular Weight | 319.36 g/mol |
| Exact Mass | 319.12 |
| IUPAC Name | 4-methoxy-3-phenoxy-N-phenylbenzamide |
| SMILES | COc1ccc(C(=O)Nc2ccccc2)cc1Oc1ccccc1 |
| InChI | InChI=1S/C20H17NO3/c1-23-18-13-12-15(20(22)21-16-8-4-2-5-9-16)14-19(18)24-17-10-6-3-7-11-17/h2-14H,1H3,(H,21,22) |
| InChIKey | JJYXDLLQYJOTDD-UHFFFAOYSA-N |
| XLogP | 4.74 |
| TPSA | 47.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 319.36 |
| LogP ≤ 5 | 4.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-methoxy-3-phenoxy-N-phenylbenzamide?
The IUPAC name of 4-methoxy-3-phenoxy-N-phenylbenzamide (CID 18626251) is 4-methoxy-3-phenoxy-N-phenylbenzamide.
What is the SMILES notation for 4-methoxy-3-phenoxy-N-phenylbenzamide?
The canonical SMILES for 4-methoxy-3-phenoxy-N-phenylbenzamide is COc1ccc(C(=O)Nc2ccccc2)cc1Oc1ccccc1.
What is the InChIKey of 4-methoxy-3-phenoxy-N-phenylbenzamide?
The InChIKey is JJYXDLLQYJOTDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO3/c1-23-18-13-12-15(20(22)21-16-8-4-2-5-9-16)14-19(18)24-17-10-6-3-7-11-17/h2-14H,1H3,(H,21,22).
What are the key properties of 4-methoxy-3-phenoxy-N-phenylbenzamide?
4-methoxy-3-phenoxy-N-phenylbenzamide has a molecular weight of 319.36 g/mol, XLogP of 4.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-phenoxy-N-phenylbenzamide is sourced from PubChem (CID 18626251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).