About 3-(2-phenylethoxy)benzamide
3-(2-phenylethoxy)benzamide (PubChem CID 17135006) has the molecular formula C15H15NO2
and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-(2-phenylethoxy)benzamide.
Molecular Properties
| Compound Name | 3-(2-phenylethoxy)benzamide |
| PubChem CID | 17135006 |
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.29 g/mol |
| Exact Mass | 241.11 |
| IUPAC Name | 3-(2-phenylethoxy)benzamide |
| SMILES | NC(=O)c1cccc(OCCc2ccccc2)c1 |
| InChI | InChI=1S/C15H15NO2/c16-15(17)13-7-4-8-14(11-13)18-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,16,17) |
| InChIKey | QNENNHJQTVYVRY-UHFFFAOYSA-N |
| XLogP | 2.41 |
| TPSA | 52.32 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.29 |
| LogP ≤ 5 | 2.41 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(2-phenylethoxy)benzamide?
The IUPAC name of 3-(2-phenylethoxy)benzamide (CID 17135006) is 3-(2-phenylethoxy)benzamide.
What is the SMILES notation for 3-(2-phenylethoxy)benzamide?
The canonical SMILES for 3-(2-phenylethoxy)benzamide is NC(=O)c1cccc(OCCc2ccccc2)c1.
What is the InChIKey of 3-(2-phenylethoxy)benzamide?
The InChIKey is QNENNHJQTVYVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c16-15(17)13-7-4-8-14(11-13)18-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,16,17).
What are the key properties of 3-(2-phenylethoxy)benzamide?
3-(2-phenylethoxy)benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenylethoxy)benzamide is sourced from PubChem (CID 17135006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).