2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide

C14H11Cl2N3O2 — CID 172722121

IUPAC2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide
SMILESNC(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C14H11Cl2N3O2/c15-7-1-3-11(17)9(5-7)14(21)19-12-4-2-8(16)6-10(12)13(18)20/h1-6H,17H2,(H2,18,20)(H,19,21)
InChIKeyGQSBMWWOJCZSBK-UHFFFAOYSA-N
MW324.17 g/mol
LogP2.93
Rot. Bonds3

About 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide

2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide (PubChem CID 172722121) has the molecular formula C14H11Cl2N3O2 and a molecular weight of 324.17 g/mol. Its IUPAC name is 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide.

Molecular Properties

Compound Name2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide
PubChem CID172722121
Molecular FormulaC14H11Cl2N3O2
Molecular Weight324.17 g/mol
Exact Mass323.02
IUPAC Name2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide
SMILESNC(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C14H11Cl2N3O2/c15-7-1-3-11(17)9(5-7)14(21)19-12-4-2-8(16)6-10(12)13(18)20/h1-6H,17H2,(H2,18,20)(H,19,21)
InChIKeyGQSBMWWOJCZSBK-UHFFFAOYSA-N
XLogP2.93
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.17
LogP ≤ 52.93
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-5-chloro-N-(2,4-difluorophenyl)benzamide
CID 16796170
2-amino-N-(2,4-dichlorophenyl)-5-hydroxybenzamide
CID 107073840
2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967454
2-amino-5-chloro-N-(4-chlorophenyl)benzamide
CID 4186019
2-amino-5-chloro-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 43574314
5-chloro-2-[(4-methylbenzoyl)amino]benzamide
CID 46934109
2-amino-N-(2-bromo-4-chlorophenyl)-5-methylbenzamide
CID 81262086
2-amino-N-(4-chloro-2-iodophenyl)-5-fluorobenzamide
CID 107624102
N-(2-amino-5-chlorophenyl)-5-chloro-2-methylbenzamide
CID 82880207
2-amino-5-chloro-N-(4-fluorophenyl)benzamide
CID 6481536
2-amino-5-chloro-N-(4-methylphenyl)benzamide
CID 6481532
2-amino-5-chloro-N-pyridin-4-ylbenzamide
CID 16770582

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide?
The IUPAC name of 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide (CID 172722121) is 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide.
What is the SMILES notation for 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide?
The canonical SMILES for 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide is NC(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1N.
What is the InChIKey of 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide?
The InChIKey is GQSBMWWOJCZSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O2/c15-7-1-3-11(17)9(5-7)14(21)19-12-4-2-8(16)6-10(12)13(18)20/h1-6H,17H2,(H2,18,20)(H,19,21).
What are the key properties of 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide?
2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide has a molecular weight of 324.17 g/mol, XLogP of 2.93, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide is sourced from PubChem (CID 172722121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).