1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone

C15H15ClN2O — CID 62052783

IUPAC1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
SMILESCN(CC(=O)c1cccc(Cl)c1)Cc1ccccn1
InChIInChI=1S/C15H15ClN2O/c1-18(10-14-7-2-3-8-17-14)11-15(19)12-5-4-6-13(16)9-12/h2-9H,10-11H2,1H3
InChIKeyRCSAQGOTUTVJDE-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.05
Rot. Bonds5

About 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone

1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone (PubChem CID 62052783) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone.

Molecular Properties

Compound Name1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
PubChem CID62052783
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
SMILESCN(CC(=O)c1cccc(Cl)c1)Cc1ccccn1
InChIInChI=1S/C15H15ClN2O/c1-18(10-14-7-2-3-8-17-14)11-15(19)12-5-4-6-13(16)9-12/h2-9H,10-11H2,1H3
InChIKeyRCSAQGOTUTVJDE-UHFFFAOYSA-N
XLogP3.05
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone 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

1-(3-chlorophenyl)-2-[methyl-[(2-methyl-1,3-thiazol-4-yl)methyl]amino]ethanone
CID 62050486
1-(3-chlorophenyl)-2-[(4-fluorophenyl)methyl-methylamino]ethanone
CID 62030758
1-(2,6-difluorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
CID 62051422
1-(2,3-dihydro-1-benzofuran-5-yl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
CID 60863461
1-(3-chlorophenyl)-2-(dimethylamino)ethanone
CID 10998918
1-(3-chlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 62053358
1-(3-chlorophenyl)-2-(2-pyridin-2-ylethoxy)ethanone
CID 62030040
3-[[methyl(pyridin-2-ylmethyl)amino]methyl]benzoic acid
CID 43565174
3-methyl-1-[methyl(pyridin-2-ylmethyl)amino]butan-2-one
CID 79396474
1-[methyl(pyridin-2-ylmethyl)amino]pentan-2-one
CID 62043779
4-[methyl(pyridin-2-ylmethyl)amino]-1-phenylbutan-1-one
CID 62050830
1-(3-chlorophenyl)-2-[methyl(3-methylbutyl)amino]ethanone
CID 61428684

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone?
The IUPAC name of 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone (CID 62052783) is 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone.
What is the SMILES notation for 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone?
The canonical SMILES for 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone is CN(CC(=O)c1cccc(Cl)c1)Cc1ccccn1.
What is the InChIKey of 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone?
The InChIKey is RCSAQGOTUTVJDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-18(10-14-7-2-3-8-17-14)11-15(19)12-5-4-6-13(16)9-12/h2-9H,10-11H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone?
1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone has a molecular weight of 274.75 g/mol, XLogP of 3.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-2-[methyl(pyridin-2-ylmethyl)amino]ethanone is sourced from PubChem (CID 62052783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).