6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione

C20H17NO3 — CID 4920696

IUPAC6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione
SMILESCc1cccc(C2CC(=O)Oc3c2c(=O)n(C)c2ccccc32)c1
InChIInChI=1S/C20H17NO3/c1-12-6-5-7-13(10-12)15-11-17(22)24-19-14-8-3-4-9-16(14)21(2)20(23)18(15)19/h3-10,15H,11H2,1-2H3
InChIKeyBRGCRAQIIFDRTR-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.29
Rot. Bonds1

About 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione

6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione (PubChem CID 4920696) has the molecular formula C20H17NO3 and a molecular weight of 319.36 g/mol. Its IUPAC name is 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione.

Molecular Properties

Compound Name6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione
PubChem CID4920696
Molecular FormulaC20H17NO3
Molecular Weight319.36 g/mol
Exact Mass319.12
IUPAC Name6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione
SMILESCc1cccc(C2CC(=O)Oc3c2c(=O)n(C)c2ccccc32)c1
InChIInChI=1S/C20H17NO3/c1-12-6-5-7-13(10-12)15-11-17(22)24-19-14-8-3-4-9-16(14)21(2)20(23)18(15)19/h3-10,15H,11H2,1-2H3
InChIKeyBRGCRAQIIFDRTR-UHFFFAOYSA-N
XLogP3.29
TPSA48.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione 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

(2-Oxo-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraen-4-yl) benzoate
CID 2786128
2,2,6-Trimethyl-2,3,4,6-tetrahydro-5H-pyrano[3,2-c]quinolin-5-one
CID 608293
Acetic acid 1-benzoyl-2,6-dimethyl-1,2,3,4-tetrahydro-quinolin-4-yl ester
CID 645583
2,6-Dimethyl-2-(4-methylpent-3-enyl)-3,4-dihydropyrano[3,2-c]quinolin-5-one
CID 44559726
2,6-Dimethyl-2-(4-methyl-3-oxopentyl)-3,4-dihydropyrano[3,2-c]quinolin-5-one
CID 44559731
Benzosimuline
CID 5321951
Butyric acid (2R,4S)-1-benzoyl-2,6-dimethyl-1,2,3,4-tetrahydro-quinolin-4-yl ester
CID 1128148
Butyric acid (2R,4R)-1-benzoyl-2,6-dimethyl-1,2,3,4-tetrahydro-quinolin-4-yl ester
CID 1128149
Butyric acid 1-benzoyl-2,6-dimethyl-1,2,3,4-tetrahydro-quinolin-4-yl ester
CID 2882340
ethyl 2-amino-5-oxo-4-phenyl-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carboxylate
CID 2929563
Propionic acid 1-benzoyl-2,6-dimethyl-1,2,3,4-tetrahydro-quinolin-4-yl ester
CID 3134422
4-(3-fluorophenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
CID 6323989

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione?
The IUPAC name of 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione (CID 4920696) is 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione.
What is the SMILES notation for 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione?
The canonical SMILES for 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione is Cc1cccc(C2CC(=O)Oc3c2c(=O)n(C)c2ccccc32)c1.
What is the InChIKey of 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione?
The InChIKey is BRGCRAQIIFDRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO3/c1-12-6-5-7-13(10-12)15-11-17(22)24-19-14-8-3-4-9-16(14)21(2)20(23)18(15)19/h3-10,15H,11H2,1-2H3.
What are the key properties of 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione?
6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione has a molecular weight of 319.36 g/mol, XLogP of 3.29, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(3-methylphenyl)-3,4-dihydropyrano[3,2-c]quinoline-2,5-dione is sourced from PubChem (CID 4920696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).