About N-(3-ethylphenyl)-3-methoxybenzamide
N-(3-ethylphenyl)-3-methoxybenzamide (PubChem CID 896052) has the molecular formula C16H17NO2
and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(3-ethylphenyl)-3-methoxybenzamide.
Molecular Properties
| Compound Name | N-(3-ethylphenyl)-3-methoxybenzamide |
| PubChem CID | 896052 |
| Molecular Formula | C16H17NO2 |
| Molecular Weight | 255.32 g/mol |
| Exact Mass | 255.13 |
| IUPAC Name | N-(3-ethylphenyl)-3-methoxybenzamide |
| SMILES | CCc1cccc(NC(=O)c2cccc(OC)c2)c1 |
| InChI | InChI=1S/C16H17NO2/c1-3-12-6-4-8-14(10-12)17-16(18)13-7-5-9-15(11-13)19-2/h4-11H,3H2,1-2H3,(H,17,18) |
| InChIKey | ZPXNFMJWJVRWKE-UHFFFAOYSA-N |
| XLogP | 3.51 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.32 |
| LogP ≤ 5 | 3.51 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-ethylphenyl)-3-methoxybenzamide?
The IUPAC name of N-(3-ethylphenyl)-3-methoxybenzamide (CID 896052) is N-(3-ethylphenyl)-3-methoxybenzamide.
What is the SMILES notation for N-(3-ethylphenyl)-3-methoxybenzamide?
The canonical SMILES for N-(3-ethylphenyl)-3-methoxybenzamide is CCc1cccc(NC(=O)c2cccc(OC)c2)c1.
What is the InChIKey of N-(3-ethylphenyl)-3-methoxybenzamide?
The InChIKey is ZPXNFMJWJVRWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-3-12-6-4-8-14(10-12)17-16(18)13-7-5-9-15(11-13)19-2/h4-11H,3H2,1-2H3,(H,17,18).
What are the key properties of N-(3-ethylphenyl)-3-methoxybenzamide?
N-(3-ethylphenyl)-3-methoxybenzamide has a molecular weight of 255.32 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-3-methoxybenzamide is sourced from PubChem (CID 896052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).