2-amino-N-(3-carbamoylphenyl)benzamide

C14H13N3O2 — CID 43402945

IUPAC2-amino-N-(3-carbamoylphenyl)benzamide
SMILESNC(=O)c1cccc(NC(=O)c2ccccc2N)c1
InChIInChI=1S/C14H13N3O2/c15-12-7-2-1-6-11(12)14(19)17-10-5-3-4-9(8-10)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19)
InChIKeyRTIPCZKHVAGZBI-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.62
Rot. Bonds3

About 2-amino-N-(3-carbamoylphenyl)benzamide

2-amino-N-(3-carbamoylphenyl)benzamide (PubChem CID 43402945) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-amino-N-(3-carbamoylphenyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(3-carbamoylphenyl)benzamide
PubChem CID43402945
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name2-amino-N-(3-carbamoylphenyl)benzamide
SMILESNC(=O)c1cccc(NC(=O)c2ccccc2N)c1
InChIInChI=1S/C14H13N3O2/c15-12-7-2-1-6-11(12)14(19)17-10-5-3-4-9(8-10)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19)
InChIKeyRTIPCZKHVAGZBI-UHFFFAOYSA-N
XLogP1.62
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(3-hydroxyphenyl)benzamide
CID 3596059
2-[(3-carbamoylphenyl)carbamoyl]benzoate
CID 3545155
2-amino-N-(3-anilinophenyl)benzamide
CID 155671979
3-[(2-carbamoylbenzoyl)amino]benzoic acid
CID 4607393
2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide
CID 115412996
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
2-amino-N-pyridin-4-ylbenzamide
CID 5080262
N-(3-carbamoylphenyl)-2-pentoxybenzamide
CID 26160536
N-[4-[(3-carbamoylphenyl)carbamothioylamino]phenyl]-2-fluorobenzamide
CID 15955740
N-(3-carbamoylphenyl)-2,5-dimethylbenzamide
CID 17394434
5-amino-N-(3-carbamoylphenyl)-2-fluoro-3-methylbenzamide
CID 103296054
3-[(3-hydroxybenzoyl)amino]benzamide
CID 103605136

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-carbamoylphenyl)benzamide?
The IUPAC name of 2-amino-N-(3-carbamoylphenyl)benzamide (CID 43402945) is 2-amino-N-(3-carbamoylphenyl)benzamide.
What is the SMILES notation for 2-amino-N-(3-carbamoylphenyl)benzamide?
The canonical SMILES for 2-amino-N-(3-carbamoylphenyl)benzamide is NC(=O)c1cccc(NC(=O)c2ccccc2N)c1.
What is the InChIKey of 2-amino-N-(3-carbamoylphenyl)benzamide?
The InChIKey is RTIPCZKHVAGZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c15-12-7-2-1-6-11(12)14(19)17-10-5-3-4-9(8-10)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19).
What are the key properties of 2-amino-N-(3-carbamoylphenyl)benzamide?
2-amino-N-(3-carbamoylphenyl)benzamide has a molecular weight of 255.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-carbamoylphenyl)benzamide is sourced from PubChem (CID 43402945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).