2-(aminomethyl)-N-(4-chlorophenyl)benzamide

C14H13ClN2O — CID 82546810

IUPAC2-(aminomethyl)-N-(4-chlorophenyl)benzamide
SMILESNCc1ccccc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O/c15-11-5-7-12(8-6-11)17-14(18)13-4-2-1-3-10(13)9-16/h1-8H,9,16H2,(H,17,18)
InChIKeyGJVPLKAYZUKRIM-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.05
Rot. Bonds3

About 2-(aminomethyl)-N-(4-chlorophenyl)benzamide

2-(aminomethyl)-N-(4-chlorophenyl)benzamide (PubChem CID 82546810) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(4-chlorophenyl)benzamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(4-chlorophenyl)benzamide
PubChem CID82546810
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC Name2-(aminomethyl)-N-(4-chlorophenyl)benzamide
SMILESNCc1ccccc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O/c15-11-5-7-12(8-6-11)17-14(18)13-4-2-1-3-10(13)9-16/h1-8H,9,16H2,(H,17,18)
InChIKeyGJVPLKAYZUKRIM-UHFFFAOYSA-N
XLogP3.05
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-N-(4-chlorophenyl)benzamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(aminomethyl)-N-(3,5-dichlorophenyl)benzamide
CID 82546015
N-(4-acetylphenyl)-2-(aminomethyl)benzamide
CID 82546626
2-(aminomethyl)-N-(5-chloro-2-hydroxyphenyl)benzamide
CID 82546409
2-(aminomethyl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 110451835
5-[[2-(aminomethyl)benzoyl]amino]benzene-1,3-dicarboxylic acid
CID 110451899
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
propyl 2-[(4-chlorophenyl)carbamoyl]benzoate
CID 71387076
2-benzylsulfanyl-N-(4-chlorophenyl)benzamide
CID 1313702
2-(hydroxymethyl)-N-phenylbenzamide
CID 14198283
2-(fluoromethyl)-N-phenylbenzamide
CID 141101349
2-ethyl-N-(4-methylphenyl)benzamide
CID 20613365
N-(4-chlorophenyl)-3-deuterio-2-methylbenzamide
CID 175815954

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(4-chlorophenyl)benzamide?
The IUPAC name of 2-(aminomethyl)-N-(4-chlorophenyl)benzamide (CID 82546810) is 2-(aminomethyl)-N-(4-chlorophenyl)benzamide.
What is the SMILES notation for 2-(aminomethyl)-N-(4-chlorophenyl)benzamide?
The canonical SMILES for 2-(aminomethyl)-N-(4-chlorophenyl)benzamide is NCc1ccccc1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(aminomethyl)-N-(4-chlorophenyl)benzamide?
The InChIKey is GJVPLKAYZUKRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c15-11-5-7-12(8-6-11)17-14(18)13-4-2-1-3-10(13)9-16/h1-8H,9,16H2,(H,17,18).
What are the key properties of 2-(aminomethyl)-N-(4-chlorophenyl)benzamide?
2-(aminomethyl)-N-(4-chlorophenyl)benzamide has a molecular weight of 260.72 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(4-chlorophenyl)benzamide is sourced from PubChem (CID 82546810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).