(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one

C15H12ClNO — CID 86312786

IUPAC(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one
SMILESO=C1C[C@H](c2ccc(Cl)cc2)Nc2ccccc21
InChIInChI=1S/C15H12ClNO/c16-11-7-5-10(6-8-11)14-9-15(18)12-3-1-2-4-13(12)17-14/h1-8,14,17H,9H2/t14-/m1/s1
InChIKeyMNTVARPFUBYZFP-CQSZACIVSA-N
MW257.72 g/mol
LogP4.08
Rot. Bonds1

About (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one

(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one (PubChem CID 86312786) has the molecular formula C15H12ClNO and a molecular weight of 257.72 g/mol. Its IUPAC name is (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one.

Molecular Properties

Compound Name(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one
PubChem CID86312786
Molecular FormulaC15H12ClNO
Molecular Weight257.72 g/mol
Exact Mass257.06
IUPAC Name(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one
SMILESO=C1C[C@H](c2ccc(Cl)cc2)Nc2ccccc21
InChIInChI=1S/C15H12ClNO/c16-11-7-5-10(6-8-11)14-9-15(18)12-3-1-2-4-13(12)17-14/h1-8,14,17H,9H2/t14-/m1/s1
InChIKeyMNTVARPFUBYZFP-CQSZACIVSA-N
XLogP4.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-fluorophenyl)-2,3-dihydro-1H-quinolin-4-one
CID 86326370
2-(4-hydroxyphenyl)-2,3-dihydro-1H-quinolin-4-one
CID 78099399
2-(3-chloro-4-hydroxyphenyl)-2,3-dihydro-1H-quinolin-4-one
CID 110539671
2-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2,3-dihydro-1H-quinolin-4-one
CID 110538830
2-(2-fluorophenyl)-2,3-dihydro-1H-quinolin-4-one
CID 11218695
CID 56964004
CID 56964004
2-(3-chloro-4-phenylmethoxyphenyl)-2,3-dihydro-1H-quinolin-4-one
CID 110534841
(6S)-6-(4-chlorophenyl)-1,3-diazinane-2,4-dione
CID 2097974
2-(4-oxo-2,3-dihydro-1H-quinolin-2-yl)phenolate;hydrofluoride
CID 139262353
(4S)-4-(4-chlorophenyl)azetidine-2-thione
CID 102306093
3-(3-chlorophenyl)-3,4-dihydro-2H-benzo[f]quinolin-1-one
CID 45035436
2-phenyl-2,3-dihydro-1H-1,8-naphthyridin-4-one
CID 132536769

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one?
The IUPAC name of (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one (CID 86312786) is (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one.
What is the SMILES notation for (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one?
The canonical SMILES for (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one is O=C1C[C@H](c2ccc(Cl)cc2)Nc2ccccc21.
What is the InChIKey of (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one?
The InChIKey is MNTVARPFUBYZFP-CQSZACIVSA-N. The full InChI is InChI=1S/C15H12ClNO/c16-11-7-5-10(6-8-11)14-9-15(18)12-3-1-2-4-13(12)17-14/h1-8,14,17H,9H2/t14-/m1/s1.
What are the key properties of (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one?
(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one has a molecular weight of 257.72 g/mol, XLogP of 4.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one is sourced from PubChem (CID 86312786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).