2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one

C23H19N3O — CID 3974222

IUPAC2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one
SMILESCc1nn2c3c(cnc2c1-c1ccccc1)C(=O)CC(c1ccccc1)C3
InChIInChI=1S/C23H19N3O/c1-15-22(17-10-6-3-7-11-17)23-24-14-19-20(26(23)25-15)12-18(13-21(19)27)16-8-4-2-5-9-16/h2-11,14,18H,12-13H2,1H3
InChIKeyDPCFNOPUCQZUNN-UHFFFAOYSA-N
MW353.43 g/mol
LogP4.62
Rot. Bonds2

About 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one

2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one (PubChem CID 3974222) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one.

Molecular Properties

Compound Name2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one
PubChem CID3974222
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC Name2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one
SMILESCc1nn2c3c(cnc2c1-c1ccccc1)C(=O)CC(c1ccccc1)C3
InChIInChI=1S/C23H19N3O/c1-15-22(17-10-6-3-7-11-17)23-24-14-19-20(26(23)25-15)12-18(13-21(19)27)16-8-4-2-5-9-16/h2-11,14,18H,12-13H2,1H3
InChIKeyDPCFNOPUCQZUNN-UHFFFAOYSA-N
XLogP4.62
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,7-dimethyl-N,3-diphenylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 936600
2-(2,3-dihydro-1H-indol-1-yl)-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one
CID 943239
1-(7-Methyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 641891
2-(3,5-dimethylpiperidin-1-yl)-7-phenyl-7,8-dihydroquinazolin-5(6H)-one
CID 664565
1-(7-Methyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 708078
1-[3-(4-Chlorophenyl)-2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]ethanone
CID 808166
2-(3,4-dihydroisoquinolin-2(1H)-yl)-7-(4-methylphenyl)-7,8-dihydroquinazolin-5(6H)-one
CID 4563710
2-(3,4-dihydroisoquinolin-2(1H)-yl)-7-phenyl-7,8-dihydroquinazolin-5(6H)-one
CID 4602970
1-(4,6-dimethylpyrimidin-2-yl)-6-(3-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
CID 16457556
1-(4-Aminoquinazolin-7-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one
CID 25062832
1-[4-[(1-Methylpyrazolo[3,4-b]quinolin-4-yl)amino]phenyl]ethanone
CID 44446747
N-[3-[3-(4-fluorobenzoyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-N-methylacetamide
CID 44452706

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one?
The IUPAC name of 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one (CID 3974222) is 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one.
What is the SMILES notation for 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one?
The canonical SMILES for 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one is Cc1nn2c3c(cnc2c1-c1ccccc1)C(=O)CC(c1ccccc1)C3.
What is the InChIKey of 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one?
The InChIKey is DPCFNOPUCQZUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O/c1-15-22(17-10-6-3-7-11-17)23-24-14-19-20(26(23)25-15)12-18(13-21(19)27)16-8-4-2-5-9-16/h2-11,14,18H,12-13H2,1H3.
What are the key properties of 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one?
2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one has a molecular weight of 353.43 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3,8-diphenyl-8,9-dihydro-7H-pyrazolo[1,5-a]quinazolin-6-one is sourced from PubChem (CID 3974222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).