2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline

C15H18ClN3 — CID 62492965

IUPAC2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline
SMILESCN(CCc1ccccn1)c1ccc(Cl)cc1CN
InChIInChI=1S/C15H18ClN3/c1-19(9-7-14-4-2-3-8-18-14)15-6-5-13(16)10-12(15)11-17/h2-6,8,10H,7,9,11,17H2,1H3
InChIKeyWWLSXUUDNMYRKY-UHFFFAOYSA-N
MW275.78 g/mol
LogP2.87
Rot. Bonds5

About 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline

2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline (PubChem CID 62492965) has the molecular formula C15H18ClN3 and a molecular weight of 275.78 g/mol. Its IUPAC name is 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline.

Molecular Properties

Compound Name2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline
PubChem CID62492965
Molecular FormulaC15H18ClN3
Molecular Weight275.78 g/mol
Exact Mass275.12
IUPAC Name2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline
SMILESCN(CCc1ccccn1)c1ccc(Cl)cc1CN
InChIInChI=1S/C15H18ClN3/c1-19(9-7-14-4-2-3-8-18-14)15-6-5-13(16)10-12(15)11-17/h2-6,8,10H,7,9,11,17H2,1H3
InChIKeyWWLSXUUDNMYRKY-UHFFFAOYSA-N
XLogP2.87
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline 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)-4-bromo-N-methyl-N-(2-pyridin-2-ylethyl)aniline
CID 114889441
4-chloro-2-(ethylaminomethyl)-N-methyl-N-(2-pyridin-2-ylethyl)aniline
CID 114847708
2-(aminomethyl)-4-chloro-N-methyl-N-(2-phenylethyl)aniline
CID 65485061
[5-chloro-2-(pyridin-2-ylmethyl)phenyl]methanamine
CID 66161310
2-iodo-1-N-methyl-1-N-(2-pyridin-2-ylethyl)benzene-1,4-diamine
CID 66094959
3,5-difluoro-1-N-methyl-1-N-(2-pyridin-2-ylethyl)benzene-1,2-diamine
CID 115506438
4-(2-aminoethyl)-N,3-dimethyl-N-(2-pyridin-2-ylethyl)aniline
CID 63784236
4-bromo-5-fluoro-1-N-methyl-1-N-(2-pyridin-2-ylethyl)benzene-1,2-diamine
CID 66110096
4-(2-aminoethyl)-N-methyl-N-(2-pyridin-2-ylethyl)aniline
CID 63784582
4-chloro-2,6-bis[[methyl(2-pyridin-2-ylethyl)amino]methyl]phenol
CID 139202506
4-(2-aminopropyl)-2-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)aniline
CID 63786109
2-chloro-4-(ethylaminomethyl)-N-methyl-N-(2-pyridin-2-ylethyl)aniline
CID 81146369

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline?
The IUPAC name of 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline (CID 62492965) is 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline.
What is the SMILES notation for 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline?
The canonical SMILES for 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline is CN(CCc1ccccn1)c1ccc(Cl)cc1CN.
What is the InChIKey of 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline?
The InChIKey is WWLSXUUDNMYRKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3/c1-19(9-7-14-4-2-3-8-18-14)15-6-5-13(16)10-12(15)11-17/h2-6,8,10H,7,9,11,17H2,1H3.
What are the key properties of 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline?
2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline has a molecular weight of 275.78 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-chloro-N-methyl-N-(2-pyridin-2-ylethyl)aniline is sourced from PubChem (CID 62492965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).