1,8-dimethyl-2,3-diphenylquinolin-4-one

C23H19NO — CID 166440034

IUPAC1,8-dimethyl-2,3-diphenylquinolin-4-one
SMILESCc1cccc2c(=O)c(-c3ccccc3)c(-c3ccccc3)n(C)c12
InChIInChI=1S/C23H19NO/c1-16-10-9-15-19-21(16)24(2)22(18-13-7-4-8-14-18)20(23(19)25)17-11-5-3-6-12-17/h3-15H,1-2H3
InChIKeyWXBYYZQNNOLNJU-UHFFFAOYSA-N
MW325.41 g/mol
LogP5.18
Rot. Bonds2

About 1,8-dimethyl-2,3-diphenylquinolin-4-one

1,8-dimethyl-2,3-diphenylquinolin-4-one (PubChem CID 166440034) has the molecular formula C23H19NO and a molecular weight of 325.41 g/mol. Its IUPAC name is 1,8-dimethyl-2,3-diphenylquinolin-4-one.

Molecular Properties

Compound Name1,8-dimethyl-2,3-diphenylquinolin-4-one
PubChem CID166440034
Molecular FormulaC23H19NO
Molecular Weight325.41 g/mol
Exact Mass325.15
IUPAC Name1,8-dimethyl-2,3-diphenylquinolin-4-one
SMILESCc1cccc2c(=O)c(-c3ccccc3)c(-c3ccccc3)n(C)c12
InChIInChI=1S/C23H19NO/c1-16-10-9-15-19-21(16)24(2)22(18-13-7-4-8-14-18)20(23(19)25)17-11-5-3-6-12-17/h3-15H,1-2H3
InChIKeyWXBYYZQNNOLNJU-UHFFFAOYSA-N
XLogP5.18
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,8-dimethyl-2,3-diphenylquinolin-4-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

6-tert-butyl-1-methyl-2,3-diphenylquinolin-4-one
CID 166440021
1-methyl-2,3-diphenylindole
CID 11426096
4,5,10-trimethylphenanthridin-6-one
CID 132522082
1,3-dimethyl-5,6-diphenylpyrimidine-2,4-dione
CID 576581
3-(1-aminoethyl)-8-chloro-1-methyl-2-phenylquinolin-4-one
CID 134229573
2-methyl-1,3-diphenylisoindole
CID 3710956
2,3,5,6-tetraphenyl-1-propylpyridin-4-one
CID 73057320
2,3-dimethyl-4-phenylisoquinolin-1-one;ethane
CID 142130095
8,9-dimethyl-2,3-dihydro-1H-carbazol-4-one
CID 84739991
1,3,8-trimethyl-2-oxoquinoline-4-carboxylic acid
CID 165484673
2-chloro-1,3,7-trimethylindole
CID 117127854
8,9-dimethyl-2H-pyrido[3,4-b]indol-1-one
CID 115027878

Frequently Asked Questions

What is the IUPAC name of 1,8-dimethyl-2,3-diphenylquinolin-4-one?
The IUPAC name of 1,8-dimethyl-2,3-diphenylquinolin-4-one (CID 166440034) is 1,8-dimethyl-2,3-diphenylquinolin-4-one.
What is the SMILES notation for 1,8-dimethyl-2,3-diphenylquinolin-4-one?
The canonical SMILES for 1,8-dimethyl-2,3-diphenylquinolin-4-one is Cc1cccc2c(=O)c(-c3ccccc3)c(-c3ccccc3)n(C)c12.
What is the InChIKey of 1,8-dimethyl-2,3-diphenylquinolin-4-one?
The InChIKey is WXBYYZQNNOLNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO/c1-16-10-9-15-19-21(16)24(2)22(18-13-7-4-8-14-18)20(23(19)25)17-11-5-3-6-12-17/h3-15H,1-2H3.
What are the key properties of 1,8-dimethyl-2,3-diphenylquinolin-4-one?
1,8-dimethyl-2,3-diphenylquinolin-4-one has a molecular weight of 325.41 g/mol, XLogP of 5.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethyl-2,3-diphenylquinolin-4-one is sourced from PubChem (CID 166440034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).