5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide

C14H12ClN3O2 — CID 28723008

IUPAC5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide
SMILESNC(=O)c1ccccc1NC(=O)c1cc(N)ccc1Cl
InChIInChI=1S/C14H12ClN3O2/c15-11-6-5-8(16)7-10(11)14(20)18-12-4-2-1-3-9(12)13(17)19/h1-7H,16H2,(H2,17,19)(H,18,20)
InChIKeyUWBDEEYXEJJWLD-UHFFFAOYSA-N
MW289.72 g/mol
LogP2.27
Rot. Bonds3

About 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide

5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide (PubChem CID 28723008) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide.

Molecular Properties

Compound Name5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide
PubChem CID28723008
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC Name5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide
SMILESNC(=O)c1ccccc1NC(=O)c1cc(N)ccc1Cl
InChIInChI=1S/C14H12ClN3O2/c15-11-6-5-8(16)7-10(11)14(20)18-12-4-2-1-3-9(12)13(17)19/h1-7H,16H2,(H2,17,19)(H,18,20)
InChIKeyUWBDEEYXEJJWLD-UHFFFAOYSA-N
XLogP2.27
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 52.27
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-(2-carbamoylphenyl)-3-chlorobenzamide
CID 80503937
5-amino-2-[(2-chlorobenzoyl)amino]benzoic acid
CID 63115639
N-(4-amino-2-chlorophenyl)-2-chlorobenzamide
CID 960633
N-(2-carbamothioylphenyl)-2,5-dichlorobenzamide
CID 28538198
5-amino-2-chloro-N-[2-(difluoromethylsulfanyl)phenyl]benzamide
CID 28551481
5-bromo-N-(2-carbamothioylphenyl)-2-chlorobenzamide
CID 43378988
N-[(2-carbamoylphenyl)carbamothioyl]-2-chloro-5-iodobenzamide
CID 1305548
5-amino-N-(2-chlorophenyl)-2-fluorobenzamide
CID 43510734
N-(5-amino-2-chlorophenyl)-2-methylbenzamide
CID 28866784
5-amino-N-(4-bromo-2-chlorophenyl)-2-chlorobenzamide
CID 43347151
5-amino-2-chloro-N-(2-chloro-4-fluorophenyl)benzamide
CID 29079625
5-amino-N-(2-carbamoylphenyl)-1-benzothiophene-2-carboxamide
CID 139568442

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide?
The IUPAC name of 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide (CID 28723008) is 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide.
What is the SMILES notation for 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide?
The canonical SMILES for 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide is NC(=O)c1ccccc1NC(=O)c1cc(N)ccc1Cl.
What is the InChIKey of 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide?
The InChIKey is UWBDEEYXEJJWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c15-11-6-5-8(16)7-10(11)14(20)18-12-4-2-1-3-9(12)13(17)19/h1-7H,16H2,(H2,17,19)(H,18,20).
What are the key properties of 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide?
5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide has a molecular weight of 289.72 g/mol, XLogP of 2.27, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-carbamoylphenyl)-2-chlorobenzamide is sourced from PubChem (CID 28723008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).