8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione

C19H15NO3 — CID 135015139

IUPAC8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione
SMILESCc1ccc(C2CC(=O)c3c(ccc4oc(=O)ccc34)N2)cc1
InChIInChI=1S/C19H15NO3/c1-11-2-4-12(5-3-11)15-10-16(21)19-13-6-9-18(22)23-17(13)8-7-14(19)20-15/h2-9,15,20H,10H2,1H3
InChIKeyKVHCUMFWBPIUNO-UHFFFAOYSA-N
MW305.33 g/mol
LogP3.84
Rot. Bonds1

About 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione

8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione (PubChem CID 135015139) has the molecular formula C19H15NO3 and a molecular weight of 305.33 g/mol. Its IUPAC name is 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione.

Molecular Properties

Compound Name8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione
PubChem CID135015139
Molecular FormulaC19H15NO3
Molecular Weight305.33 g/mol
Exact Mass305.11
IUPAC Name8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione
SMILESCc1ccc(C2CC(=O)c3c(ccc4oc(=O)ccc34)N2)cc1
InChIInChI=1S/C19H15NO3/c1-11-2-4-12(5-3-11)15-10-16(21)19-13-6-9-18(22)23-17(13)8-7-14(19)20-15/h2-9,15,20H,10H2,1H3
InChIKeyKVHCUMFWBPIUNO-UHFFFAOYSA-N
XLogP3.84
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-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

3-(3-chlorophenyl)-3,4-dihydro-2H-benzo[f]quinolin-1-one
CID 45035436
5-(4-methylphenyl)pyrrolidin-3-one;hydrochloride
CID 115027658
2-(4-methylphenyl)-2,3-dihydro-1H-4,1-benzoxazepin-5-one
CID 102291977
4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
CID 5150094
(3R)-3-(2-methoxyphenyl)-3,4-dihydro-2H-benzo[f]quinolin-1-one
CID 781607
3-(2-methoxyphenyl)-3,4-dihydro-2H-benzo[f]quinolin-1-one
CID 2869986
[2-methoxy-4-[(3R)-1-oxo-3,4-dihydro-2H-benzo[f]quinolin-3-yl]phenyl] propanoate
CID 1261142
(2S)-2-(4-fluorophenyl)-2,3-dihydro-1H-quinolin-4-one
CID 86326370
6-(4-methylphenyl)-2-oxo-5,6-dihydro-1H-pyrimidine-4-carboxylic acid
CID 170923694
5,7-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
CID 4013983
2-(4-hydroxyphenyl)-2,3-dihydro-1H-quinolin-4-one
CID 78099399
(2R)-2-(4-chlorophenyl)-2,3-dihydro-1H-quinolin-4-one
CID 86312786

Frequently Asked Questions

What is the IUPAC name of 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione?
The IUPAC name of 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione (CID 135015139) is 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione.
What is the SMILES notation for 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione?
The canonical SMILES for 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione is Cc1ccc(C2CC(=O)c3c(ccc4oc(=O)ccc34)N2)cc1.
What is the InChIKey of 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione?
The InChIKey is KVHCUMFWBPIUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3/c1-11-2-4-12(5-3-11)15-10-16(21)19-13-6-9-18(22)23-17(13)8-7-14(19)20-15/h2-9,15,20H,10H2,1H3.
What are the key properties of 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione?
8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione has a molecular weight of 305.33 g/mol, XLogP of 3.84, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methylphenyl)-8,9-dihydro-7H-pyrano[3,2-f]quinoline-3,10-dione is sourced from PubChem (CID 135015139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).