About 2-amino-N-(3-anilinophenyl)benzamide
2-amino-N-(3-anilinophenyl)benzamide (PubChem CID 155671979) has the molecular formula C19H17N3O
and a molecular weight of 303.37 g/mol. Its IUPAC name is 2-amino-N-(3-anilinophenyl)benzamide.
Molecular Properties
| Compound Name | 2-amino-N-(3-anilinophenyl)benzamide |
| PubChem CID | 155671979 |
| Molecular Formula | C19H17N3O |
| Molecular Weight | 303.37 g/mol |
| Exact Mass | 303.14 |
| IUPAC Name | 2-amino-N-(3-anilinophenyl)benzamide |
| SMILES | Nc1ccccc1C(=O)Nc1cccc(Nc2ccccc2)c1 |
| InChI | InChI=1S/C19H17N3O/c20-18-12-5-4-11-17(18)19(23)22-16-10-6-9-15(13-16)21-14-7-2-1-3-8-14/h1-13,21H,20H2,(H,22,23) |
| InChIKey | UFINNZCAEZHRIN-UHFFFAOYSA-N |
| XLogP | 4.26 |
| TPSA | 67.15 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 303.37 |
| LogP ≤ 5 | 4.26 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-amino-N-(3-anilinophenyl)benzamide?
The IUPAC name of 2-amino-N-(3-anilinophenyl)benzamide (CID 155671979) is 2-amino-N-(3-anilinophenyl)benzamide.
What is the SMILES notation for 2-amino-N-(3-anilinophenyl)benzamide?
The canonical SMILES for 2-amino-N-(3-anilinophenyl)benzamide is Nc1ccccc1C(=O)Nc1cccc(Nc2ccccc2)c1.
What is the InChIKey of 2-amino-N-(3-anilinophenyl)benzamide?
The InChIKey is UFINNZCAEZHRIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c20-18-12-5-4-11-17(18)19(23)22-16-10-6-9-15(13-16)21-14-7-2-1-3-8-14/h1-13,21H,20H2,(H,22,23).
What are the key properties of 2-amino-N-(3-anilinophenyl)benzamide?
2-amino-N-(3-anilinophenyl)benzamide has a molecular weight of 303.37 g/mol, XLogP of 4.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-anilinophenyl)benzamide is sourced from PubChem (CID 155671979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).