N-(benzamidocarbamoyl)benzamide

C15H13N3O3 — CID 28161

IUPACN-(benzamidocarbamoyl)benzamide
SMILESO=C(NNC(=O)c1ccccc1)NC(=O)c1ccccc1
InChIInChI=1S/C15H13N3O3/c19-13(11-7-3-1-4-8-11)16-15(21)18-17-14(20)12-9-5-2-6-10-12/h1-10H,(H,17,20)(H2,16,18,19,21)
InChIKeyNHXXLEBCTOQKJS-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.47
Rot. Bonds2

About N-(benzamidocarbamoyl)benzamide

N-(benzamidocarbamoyl)benzamide (PubChem CID 28161) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-(benzamidocarbamoyl)benzamide.

Molecular Properties

Compound NameN-(benzamidocarbamoyl)benzamide
PubChem CID28161
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC NameN-(benzamidocarbamoyl)benzamide
SMILESO=C(NNC(=O)c1ccccc1)NC(=O)c1ccccc1
InChIInChI=1S/C15H13N3O3/c19-13(11-7-3-1-4-8-11)16-15(21)18-17-14(20)12-9-5-2-6-10-12/h1-10H,(H,17,20)(H2,16,18,19,21)
InChIKeyNHXXLEBCTOQKJS-UHFFFAOYSA-N
XLogP1.47
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(benzamidocarbamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(benzamidocarbamoyl)benzamide?
The IUPAC name of N-(benzamidocarbamoyl)benzamide (CID 28161) is N-(benzamidocarbamoyl)benzamide.
What is the SMILES notation for N-(benzamidocarbamoyl)benzamide?
The canonical SMILES for N-(benzamidocarbamoyl)benzamide is O=C(NNC(=O)c1ccccc1)NC(=O)c1ccccc1.
What is the InChIKey of N-(benzamidocarbamoyl)benzamide?
The InChIKey is NHXXLEBCTOQKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c19-13(11-7-3-1-4-8-11)16-15(21)18-17-14(20)12-9-5-2-6-10-12/h1-10H,(H,17,20)(H2,16,18,19,21).
What are the key properties of N-(benzamidocarbamoyl)benzamide?
N-(benzamidocarbamoyl)benzamide has a molecular weight of 283.29 g/mol, XLogP of 1.47, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzamidocarbamoyl)benzamide is sourced from PubChem (CID 28161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).