About N-(3-acetamidophenyl)-3-chlorobenzamide
N-(3-acetamidophenyl)-3-chlorobenzamide (PubChem CID 669190) has the molecular formula C15H13ClN2O2
and a molecular weight of 288.73 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-chlorobenzamide.
Molecular Properties
| Compound Name | N-(3-acetamidophenyl)-3-chlorobenzamide |
| PubChem CID | 669190 |
| Molecular Formula | C15H13ClN2O2 |
| Molecular Weight | 288.73 g/mol |
| Exact Mass | 288.07 |
| IUPAC Name | N-(3-acetamidophenyl)-3-chlorobenzamide |
| SMILES | CC(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1 |
| InChI | InChI=1S/C15H13ClN2O2/c1-10(19)17-13-6-3-7-14(9-13)18-15(20)11-4-2-5-12(16)8-11/h2-9H,1H3,(H,17,19)(H,18,20) |
| InChIKey | XZMOBKLRYXTSSS-UHFFFAOYSA-N |
| XLogP | 3.55 |
| TPSA | 58.20 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 288.73 |
| LogP ≤ 5 | 3.55 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-acetamidophenyl)-3-chlorobenzamide?
The IUPAC name of N-(3-acetamidophenyl)-3-chlorobenzamide (CID 669190) is N-(3-acetamidophenyl)-3-chlorobenzamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-chlorobenzamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-chlorobenzamide is CC(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-3-chlorobenzamide?
The InChIKey is XZMOBKLRYXTSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c1-10(19)17-13-6-3-7-14(9-13)18-15(20)11-4-2-5-12(16)8-11/h2-9H,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(3-acetamidophenyl)-3-chlorobenzamide?
N-(3-acetamidophenyl)-3-chlorobenzamide has a molecular weight of 288.73 g/mol, XLogP of 3.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-chlorobenzamide is sourced from PubChem (CID 669190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).