8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one

C18H17N3O — CID 804021

IUPAC8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one
SMILESCC1(C)CC(=O)c2cnc3cc(-c4ccccc4)nn3c2C1
InChIInChI=1S/C18H17N3O/c1-18(2)9-15-13(16(22)10-18)11-19-17-8-14(20-21(15)17)12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3
InChIKeyQTTDPSKRHCLULX-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.55
Rot. Bonds1

About 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one

8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one (PubChem CID 804021) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one.

Molecular Properties

Compound Name8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one
PubChem CID804021
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC Name8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one
SMILESCC1(C)CC(=O)c2cnc3cc(-c4ccccc4)nn3c2C1
InChIInChI=1S/C18H17N3O/c1-18(2)9-15-13(16(22)10-18)11-19-17-8-14(20-21(15)17)12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3
InChIKeyQTTDPSKRHCLULX-UHFFFAOYSA-N
XLogP3.55
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one with MolForge

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Related Compounds

Ocinaplon
CID 216456
7-Bromo-3,6,6-trimethyl-1-pyridin-2-yl-5,7-dihydroindazol-4-one
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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-(2,3-dihydro-1H-indol-1-yl)-7,8-dihydroquinazolin-5(6H)-one
CID 663648
3,3-dimethyl-3,4-dihydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
CID 666060
1-[2-(4-Chlorophenyl)-7-Methylpyrazolo[1,5-A]Pyrimidin-6-Yl]Ethan-1-One
CID 677918
1-(7-Methyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 708078
6,6-Dimethyl-2-phenyl-3-pyridin-4-yl-5,7-dihydroindazol-4-one
CID 752155
1-(4,6-dimethylpyrimidin-2-yl)-6-(3-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
CID 16457556
1-[4-[(1,3-Dimethylpyrazolo[3,4-b]quinolin-4-yl)amino]phenyl]ethanone
CID 5063441

Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one?
The IUPAC name of 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one (CID 804021) is 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one.
What is the SMILES notation for 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one?
The canonical SMILES for 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one is CC1(C)CC(=O)c2cnc3cc(-c4ccccc4)nn3c2C1.
What is the InChIKey of 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one?
The InChIKey is QTTDPSKRHCLULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-18(2)9-15-13(16(22)10-18)11-19-17-8-14(20-21(15)17)12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3.
What are the key properties of 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one?
8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one has a molecular weight of 291.35 g/mol, XLogP of 3.55, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-2-phenyl-7,9-dihydropyrazolo[1,5-a]quinazolin-6-one is sourced from PubChem (CID 804021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).