6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one

C16H14ClNO — CID 167292467

IUPAC6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cccc(-c2ccc3c(c2)CCC(=O)N3)c1Cl
InChIInChI=1S/C16H14ClNO/c1-10-3-2-4-13(16(10)17)11-5-7-14-12(9-11)6-8-15(19)18-14/h2-5,7,9H,6,8H2,1H3,(H,18,19)
InChIKeyZEPCXUNKSYBIFW-UHFFFAOYSA-N
MW271.75 g/mol
LogP4.20
Rot. Bonds1

About 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one

6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 167292467) has the molecular formula C16H14ClNO and a molecular weight of 271.75 g/mol. Its IUPAC name is 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID167292467
Molecular FormulaC16H14ClNO
Molecular Weight271.75 g/mol
Exact Mass271.08
IUPAC Name6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cccc(-c2ccc3c(c2)CCC(=O)N3)c1Cl
InChIInChI=1S/C16H14ClNO/c1-10-3-2-4-13(16(10)17)11-5-7-14-12(9-11)6-8-15(19)18-14/h2-5,7,9H,6,8H2,1H3,(H,18,19)
InChIKeyZEPCXUNKSYBIFW-UHFFFAOYSA-N
XLogP4.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(3-methoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 163249682
6-chloro-3,4-dihydro-1H-quinolin-2-one
CID 11240825
6-[4-(dimethylamino)phenyl]-3,4-dihydro-1H-quinolin-2-one
CID 12001471
6-(2,6-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one
CID 43160665
6-[(2-bromo-3-methylphenyl)-chloromethyl]-3,4-dihydro-1H-quinolin-2-one
CID 107983452
6-(5-fluoro-2-methyl-1H-imidazol-4-yl)-3,4-dihydro-1H-quinolin-2-one
CID 166047857
5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one
CID 122655643
6-(5-amino-6-methylpyrimidin-4-yl)-3,4-dihydro-1H-quinolin-2-one
CID 82481969
6-[1-chloro-2-(2-methylphenyl)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 61084763
6-[bromo-(2,3-dimethylphenyl)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 61098118
6-[(3-chlorophenyl)-(methylamino)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 43483923
6-(4-phenoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 68591635

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one (CID 167292467) is 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one is Cc1cccc(-c2ccc3c(c2)CCC(=O)N3)c1Cl.
What is the InChIKey of 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is ZEPCXUNKSYBIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO/c1-10-3-2-4-13(16(10)17)11-5-7-14-12(9-11)6-8-15(19)18-14/h2-5,7,9H,6,8H2,1H3,(H,18,19).
What are the key properties of 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one?
6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 271.75 g/mol, XLogP of 4.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 167292467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).