2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone

C14H12ClNO — CID 55221466

IUPAC2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
SMILESCc1cccc(C(=O)Cc2cccc(Cl)c2)n1
InChIInChI=1S/C14H12ClNO/c1-10-4-2-7-13(16-10)14(17)9-11-5-3-6-12(15)8-11/h2-8H,9H2,1H3
InChIKeyFDPZPPRRMNDHNV-UHFFFAOYSA-N
MW245.71 g/mol
LogP3.47
Rot. Bonds3

About 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone

2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone (PubChem CID 55221466) has the molecular formula C14H12ClNO and a molecular weight of 245.71 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
PubChem CID55221466
Molecular FormulaC14H12ClNO
Molecular Weight245.71 g/mol
Exact Mass245.06
IUPAC Name2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
SMILESCc1cccc(C(=O)Cc2cccc(Cl)c2)n1
InChIInChI=1S/C14H12ClNO/c1-10-4-2-7-13(16-10)14(17)9-11-5-3-6-12(15)8-11/h2-8H,9H2,1H3
InChIKeyFDPZPPRRMNDHNV-UHFFFAOYSA-N
XLogP3.47
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.71
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)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

2-(3,4-dichlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 63554876
2-(2,5-dichlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 65321217
2-(3,5-dimethylphenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 55222118
2-(3-bromo-4-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 63555057
1-(6-methyl-2-pyridinyl)-2-(4-propan-2-ylphenyl)ethanone
CID 55221684
N-[(2R)-1-(3-chlorophenyl)propan-2-yl]-6-methylpyridine-2-carboxamide
CID 51728766
2-(3-chlorophenyl)-1-(3-ethyl-6-methylpyridazin-4-yl)ethanone
CID 105078240
2-(3-fluoro-4-methoxyphenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 63553614
1-(6-methyl-2-pyridinyl)-2-pyrazolo[1,5-a]pyridin-5-ylethanone
CID 154605174
2-(3-chlorophenyl)-1-(2-methylphenyl)ethanone
CID 60799246
N-(3-chlorophenyl)-6-methylpyridine-2-carboxamide
CID 31698646
2-(2,5-difluorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 63556118

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone?
The IUPAC name of 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone (CID 55221466) is 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone?
The canonical SMILES for 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone is Cc1cccc(C(=O)Cc2cccc(Cl)c2)n1.
What is the InChIKey of 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone?
The InChIKey is FDPZPPRRMNDHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO/c1-10-4-2-7-13(16-10)14(17)9-11-5-3-6-12(15)8-11/h2-8H,9H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone?
2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone has a molecular weight of 245.71 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone is sourced from PubChem (CID 55221466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).