About 2-[(3-phenylmethoxyphenyl)methoxy]benzamide
2-[(3-phenylmethoxyphenyl)methoxy]benzamide (PubChem CID 60603891) has the molecular formula C21H19NO3
and a molecular weight of 333.39 g/mol. Its IUPAC name is 2-[(3-phenylmethoxyphenyl)methoxy]benzamide.
Molecular Properties
| Compound Name | 2-[(3-phenylmethoxyphenyl)methoxy]benzamide |
| PubChem CID | 60603891 |
| Molecular Formula | C21H19NO3 |
| Molecular Weight | 333.39 g/mol |
| Exact Mass | 333.14 |
| IUPAC Name | 2-[(3-phenylmethoxyphenyl)methoxy]benzamide |
| SMILES | NC(=O)c1ccccc1OCc1cccc(OCc2ccccc2)c1 |
| InChI | InChI=1S/C21H19NO3/c22-21(23)19-11-4-5-12-20(19)25-15-17-9-6-10-18(13-17)24-14-16-7-2-1-3-8-16/h1-13H,14-15H2,(H2,22,23) |
| InChIKey | MYRHOSWVLXLFNA-UHFFFAOYSA-N |
| XLogP | 3.94 |
| TPSA | 61.55 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 333.39 |
| LogP ≤ 5 | 3.94 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(3-phenylmethoxyphenyl)methoxy]benzamide?
The IUPAC name of 2-[(3-phenylmethoxyphenyl)methoxy]benzamide (CID 60603891) is 2-[(3-phenylmethoxyphenyl)methoxy]benzamide.
What is the SMILES notation for 2-[(3-phenylmethoxyphenyl)methoxy]benzamide?
The canonical SMILES for 2-[(3-phenylmethoxyphenyl)methoxy]benzamide is NC(=O)c1ccccc1OCc1cccc(OCc2ccccc2)c1.
What is the InChIKey of 2-[(3-phenylmethoxyphenyl)methoxy]benzamide?
The InChIKey is MYRHOSWVLXLFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO3/c22-21(23)19-11-4-5-12-20(19)25-15-17-9-6-10-18(13-17)24-14-16-7-2-1-3-8-16/h1-13H,14-15H2,(H2,22,23).
What are the key properties of 2-[(3-phenylmethoxyphenyl)methoxy]benzamide?
2-[(3-phenylmethoxyphenyl)methoxy]benzamide has a molecular weight of 333.39 g/mol, XLogP of 3.94, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-phenylmethoxyphenyl)methoxy]benzamide is sourced from PubChem (CID 60603891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).