About 2-(3-methylphenoxy)benzamide
2-(3-methylphenoxy)benzamide (PubChem CID 70968841) has the molecular formula C14H13NO2
and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(3-methylphenoxy)benzamide.
Molecular Properties
| Compound Name | 2-(3-methylphenoxy)benzamide |
| PubChem CID | 70968841 |
| Molecular Formula | C14H13NO2 |
| Molecular Weight | 227.26 g/mol |
| Exact Mass | 227.09 |
| IUPAC Name | 2-(3-methylphenoxy)benzamide |
| SMILES | Cc1cccc(Oc2ccccc2C(N)=O)c1 |
| InChI | InChI=1S/C14H13NO2/c1-10-5-4-6-11(9-10)17-13-8-3-2-7-12(13)14(15)16/h2-9H,1H3,(H2,15,16) |
| InChIKey | QAVMYUPJLMLYMF-UHFFFAOYSA-N |
| XLogP | 2.89 |
| TPSA | 52.32 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.26 |
| LogP ≤ 5 | 2.89 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-methylphenoxy)benzamide?
The IUPAC name of 2-(3-methylphenoxy)benzamide (CID 70968841) is 2-(3-methylphenoxy)benzamide.
What is the SMILES notation for 2-(3-methylphenoxy)benzamide?
The canonical SMILES for 2-(3-methylphenoxy)benzamide is Cc1cccc(Oc2ccccc2C(N)=O)c1.
What is the InChIKey of 2-(3-methylphenoxy)benzamide?
The InChIKey is QAVMYUPJLMLYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c1-10-5-4-6-11(9-10)17-13-8-3-2-7-12(13)14(15)16/h2-9H,1H3,(H2,15,16).
What are the key properties of 2-(3-methylphenoxy)benzamide?
2-(3-methylphenoxy)benzamide has a molecular weight of 227.26 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)benzamide is sourced from PubChem (CID 70968841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).