About N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide
N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide (PubChem CID 59014791) has the molecular formula C21H19NO2
and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide.
Molecular Properties
| Compound Name | N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide |
| PubChem CID | 59014791 |
| Molecular Formula | C21H19NO2 |
| Molecular Weight | 317.39 g/mol |
| Exact Mass | 317.14 |
| IUPAC Name | N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide |
| SMILES | Cc1cccc(NC(=O)Cc2cccc(Oc3ccccc3)c2)c1 |
| InChI | InChI=1S/C21H19NO2/c1-16-7-5-9-18(13-16)22-21(23)15-17-8-6-12-20(14-17)24-19-10-3-2-4-11-19/h2-14H,15H2,1H3,(H,22,23) |
| InChIKey | HXPJPKYHAURCDU-UHFFFAOYSA-N |
| XLogP | 4.97 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 317.39 |
| LogP ≤ 5 | 4.97 |
| 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-methylphenyl)-2-(3-phenoxyphenyl)acetamide?
The IUPAC name of N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide (CID 59014791) is N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide is Cc1cccc(NC(=O)Cc2cccc(Oc3ccccc3)c2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide?
The InChIKey is HXPJPKYHAURCDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-16-7-5-9-18(13-16)22-21(23)15-17-8-6-12-20(14-17)24-19-10-3-2-4-11-19/h2-14H,15H2,1H3,(H,22,23).
What are the key properties of N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide?
N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide has a molecular weight of 317.39 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide is sourced from PubChem (CID 59014791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).