1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one

C16H12ClNO2 — CID 54679720

IUPAC1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1Cc1ccccc1Cl
InChIInChI=1S/C16H12ClNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2
InChIKeyJXFFFGNKDCMVJT-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.41
Rot. Bonds2

About 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one

1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one (PubChem CID 54679720) has the molecular formula C16H12ClNO2 and a molecular weight of 285.73 g/mol. Its IUPAC name is 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one.

Molecular Properties

Compound Name1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one
PubChem CID54679720
Molecular FormulaC16H12ClNO2
Molecular Weight285.73 g/mol
Exact Mass285.06
IUPAC Name1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1Cc1ccccc1Cl
InChIInChI=1S/C16H12ClNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2
InChIKeyJXFFFGNKDCMVJT-UHFFFAOYSA-N
XLogP3.41
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one 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

4-hydroxy-1-(2-hydroxyethyl)quinolin-2-one
CID 54738067
6-[(2-chlorophenyl)methyl]benzo[d][2]benzazepine-5,7-dione
CID 17129349
1-[(2-chlorophenyl)methyl]-3-methylquinazoline-2,4-dione
CID 944822
3-(3-chlorophenyl)-1-[(2-chlorophenyl)methyl]quinazoline-2,4-dione
CID 17147919
1-[(2-chlorophenyl)methyl]-3-(3,4-dichlorophenyl)quinazoline-2,4-dione
CID 17159909
[1-[(2-chlorophenyl)methyl]-2-hydroxyindol-3-yl]iminourea
CID 2406850
3-[(2-chlorophenyl)methyl]-1-[(4-methylphenyl)methyl]quinazoline-2,4-dione
CID 15988071
3,5-bis[(2-chlorophenyl)methyl]pyrimido[5,4-b]indol-4-one
CID 53026433
N-[1-[(2-chlorophenyl)methyl]-2-hydroxyindol-3-yl]iminobenzenesulfonamide
CID 2461663
1-[(2-chlorophenyl)methyl]-3-(furan-2-ylmethyl)quinazoline-2,4-dione
CID 4618338
1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one
CID 54729466
1-[(2-chloro-6-fluorophenyl)methyl]-4-methylquinolin-2-one
CID 39767907

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one?
The IUPAC name of 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one (CID 54679720) is 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one.
What is the SMILES notation for 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one?
The canonical SMILES for 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one is O=c1cc(O)c2ccccc2n1Cc1ccccc1Cl.
What is the InChIKey of 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one?
The InChIKey is JXFFFGNKDCMVJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2.
What are the key properties of 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one?
1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one has a molecular weight of 285.73 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chlorophenyl)methyl]-4-hydroxyquinolin-2-one is sourced from PubChem (CID 54679720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).