1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one

C17H17NO — CID 20689381

IUPAC1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one
SMILESCC1C(=O)N(C)c2ccccc2C1c1ccccc1
InChIInChI=1S/C17H17NO/c1-12-16(13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-12,16H,1-2H3
InChIKeyRACNXTPJEJITSD-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.43
Rot. Bonds1

About 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one

1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one (PubChem CID 20689381) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one
PubChem CID20689381
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one
SMILESCC1C(=O)N(C)c2ccccc2C1c1ccccc1
InChIInChI=1S/C17H17NO/c1-12-16(13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-12,16H,1-2H3
InChIKeyRACNXTPJEJITSD-UHFFFAOYSA-N
XLogP3.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-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

3-amino-1-methyl-4-phenyl-3,4-dihydroquinolin-2-one
CID 22312029
10-methyl-9-(10-methyl-9H-acridin-9-yl)-9H-acridine
CID 11079635
3-amino-1-methyl-5-phenyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 22599547
4,6-dimethyl-4a,10b-dihydropyrano[3,2-c]quinoline-2,5-dione
CID 5050390
(3S,5S)-3-amino-1-methyl-5-phenyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 129383805
(4aR,10bS)-4,6-dimethyl-4a,10b-dihydropyrano[3,2-c]quinoline-2,5-dione
CID 40534710
(3S)-3-cyclohexyl-1-methyl-3H-indol-2-one
CID 135061670
3-benzyl-1-methyl-3H-indol-2-one
CID 11207126
(3R)-3-ethyl-1-methyl-3H-indol-2-one
CID 51382688
(3R)-1-methyl-3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-3H-indol-2-one
CID 102025482
3-amino-1,5-dimethyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 22312414
3-(1-butyl-2-oxo-3H-indol-3-yl)-1-methyl-3H-indol-2-one
CID 101259896

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one (CID 20689381) is 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one is CC1C(=O)N(C)c2ccccc2C1c1ccccc1.
What is the InChIKey of 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one?
The InChIKey is RACNXTPJEJITSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-12-16(13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-12,16H,1-2H3.
What are the key properties of 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one?
1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one has a molecular weight of 251.33 g/mol, XLogP of 3.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-phenyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 20689381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).