5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

C18H15ClFN3 — CID 4102795

IUPAC5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCc1ccc2c(c1)-c1cc(C)nn1C(c1c(F)cccc1Cl)N2
InChIInChI=1S/C18H15ClFN3/c1-10-6-7-15-12(8-10)16-9-11(2)22-23(16)18(21-15)17-13(19)4-3-5-14(17)20/h3-9,18,21H,1-2H3
InChIKeyOSBPOEQXJAIXEO-UHFFFAOYSA-N
MW327.79 g/mol
LogP4.93
Rot. Bonds1

About 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline

5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (PubChem CID 4102795) has the molecular formula C18H15ClFN3 and a molecular weight of 327.79 g/mol. Its IUPAC name is 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
PubChem CID4102795
Molecular FormulaC18H15ClFN3
Molecular Weight327.79 g/mol
Exact Mass327.09
IUPAC Name5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
SMILESCc1ccc2c(c1)-c1cc(C)nn1C(c1c(F)cccc1Cl)N2
InChIInChI=1S/C18H15ClFN3/c1-10-6-7-15-12(8-10)16-9-11(2)22-23(16)18(21-15)17-13(19)4-3-5-14(17)20/h3-9,18,21H,1-2H3
InChIKeyOSBPOEQXJAIXEO-UHFFFAOYSA-N
XLogP4.93
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.79
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline 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-Methyl-5-phenyl-3,5-dihydropyrazolo[1,5-c]quinazoline
CID 646753
5-(2-Chlorophenyl)-2-methyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 652880
N-[4-(2,7,9-trimethyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenyl]acetamide
CID 3158722
2-(4-Chloro-phenyl)-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135513694
[4-[5-[(2-Chlorophenyl)methyl]-2-(2,6-diethylphenyl)-6,6-dimethyl-4,7-dihydropyrazolo[4,3-c]pyridin-3-yl]-2,5-difluorophenyl]urea
CID 139296235
Dimethyl-[4-(2-methyl-5,6-dihydro-pyrazolo[1,5-c]quinazolin-5-yl)-phenyl]-amine
CID 656199
5-(2-Fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 3158674
N,N-diethyl-4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)aniline
CID 4430536
2-Phenyl-5,6-dihydropyrazolo[1,5-c]quinazoline
CID 135456674
2-(4-Chlorophenyl)-5,6-dihydropyrazolo[1,5-c]quinazolin-5-ol
CID 168299896
8-chloro-5-(4-chlorophenyl)-5-methyl-6H-pyrazolo[1,5-c]quinazoline
CID 139267152
2,7-Dimethyl-5-[(1Z)-2-phenylethenyl]-5H,6H-pyrazolo[1,5-C]quinazoline
CID 135686062

Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The IUPAC name of 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline (CID 4102795) is 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline.
What is the SMILES notation for 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The canonical SMILES for 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is Cc1ccc2c(c1)-c1cc(C)nn1C(c1c(F)cccc1Cl)N2.
What is the InChIKey of 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
The InChIKey is OSBPOEQXJAIXEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClFN3/c1-10-6-7-15-12(8-10)16-9-11(2)22-23(16)18(21-15)17-13(19)4-3-5-14(17)20/h3-9,18,21H,1-2H3.
What are the key properties of 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline?
5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline has a molecular weight of 327.79 g/mol, XLogP of 4.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-6-fluorophenyl)-2,9-dimethyl-5,6-dihydropyrazolo[1,5-c]quinazoline is sourced from PubChem (CID 4102795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).