About N-(4-chlorophenyl)-4-(methylamino)benzamide
N-(4-chlorophenyl)-4-(methylamino)benzamide (PubChem CID 62166017) has the molecular formula C14H13ClN2O
and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-(methylamino)benzamide.
Molecular Properties
| Compound Name | N-(4-chlorophenyl)-4-(methylamino)benzamide |
| PubChem CID | 62166017 |
| Molecular Formula | C14H13ClN2O |
| Molecular Weight | 260.72 g/mol |
| Exact Mass | 260.07 |
| IUPAC Name | N-(4-chlorophenyl)-4-(methylamino)benzamide |
| SMILES | CNc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1 |
| InChI | InChI=1S/C14H13ClN2O/c1-16-12-6-2-10(3-7-12)14(18)17-13-8-4-11(15)5-9-13/h2-9,16H,1H3,(H,17,18) |
| InChIKey | SKSKWVDWTDIHNZ-UHFFFAOYSA-N |
| XLogP | 3.63 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.72 |
| LogP ≤ 5 | 3.63 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-chlorophenyl)-4-(methylamino)benzamide?
The IUPAC name of N-(4-chlorophenyl)-4-(methylamino)benzamide (CID 62166017) is N-(4-chlorophenyl)-4-(methylamino)benzamide.
What is the SMILES notation for N-(4-chlorophenyl)-4-(methylamino)benzamide?
The canonical SMILES for N-(4-chlorophenyl)-4-(methylamino)benzamide is CNc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1.
What is the InChIKey of N-(4-chlorophenyl)-4-(methylamino)benzamide?
The InChIKey is SKSKWVDWTDIHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-16-12-6-2-10(3-7-12)14(18)17-13-8-4-11(15)5-9-13/h2-9,16H,1H3,(H,17,18).
What are the key properties of N-(4-chlorophenyl)-4-(methylamino)benzamide?
N-(4-chlorophenyl)-4-(methylamino)benzamide has a molecular weight of 260.72 g/mol, XLogP of 3.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-4-(methylamino)benzamide is sourced from PubChem (CID 62166017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).