9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

C16H9F2N3O — CID 10017510

IUPAC9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESO=c1c2cnc3cccc(F)c3c2[nH]n1-c1ccccc1F
InChIInChI=1S/C16H9F2N3O/c17-10-4-1-2-7-13(10)21-16(22)9-8-19-12-6-3-5-11(18)14(12)15(9)20-21/h1-8,20H
InChIKeyJBLIPVBOXSMCAJ-UHFFFAOYSA-N
MW297.26 g/mol
LogP3.15
Rot. Bonds1

About 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one

9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 10017510) has the molecular formula C16H9F2N3O and a molecular weight of 297.26 g/mol. Its IUPAC name is 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

Compound Name9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
PubChem CID10017510
Molecular FormulaC16H9F2N3O
Molecular Weight297.26 g/mol
Exact Mass297.07
IUPAC Name9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESO=c1c2cnc3cccc(F)c3c2[nH]n1-c1ccccc1F
InChIInChI=1S/C16H9F2N3O/c17-10-4-1-2-7-13(10)21-16(22)9-8-19-12-6-3-5-11(18)14(12)15(9)20-21/h1-8,20H
InChIKeyJBLIPVBOXSMCAJ-UHFFFAOYSA-N
XLogP3.15
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.26
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_B(7)', 'substructure': 'N/A'}

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Related Compounds

7,8-difluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 58189295
8-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 58189277
2-(2-chlorophenyl)-6-fluoro-9-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 678872
4-fluoro-1-(2-fluorophenyl)-2H-indazol-3-one
CID 57420560
2-(2-fluorophenyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-one
CID 105494040
4-amino-5-cyclopropyl-2-(2-fluorophenyl)-1H-pyrazol-3-one
CID 103994907
4-chloro-5-fluoroquinoline-3-carbaldehyde
CID 131448573
6,9-dimethoxy-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 46397836
3-amino-2-(2-fluorophenyl)-1H-pyrazol-5-one
CID 61263646
5-(2-fluorophenyl)-1,5,9,11-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),3,8,10,12,14,16-heptaen-6-one
CID 30466223
5-tert-butyl-2-(2-fluorophenyl)-3-oxo-1H-pyrazole-4-carboxylic acid
CID 117123667
2-(2-chlorophenyl)-6,7,8,9-tetrahydro-1H-pyrazolo[4,3-c]quinolin-3-one;hydrochloride
CID 159576685

Frequently Asked Questions

What is the IUPAC name of 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The IUPAC name of 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one (CID 10017510) is 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one.
What is the SMILES notation for 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The canonical SMILES for 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is O=c1c2cnc3cccc(F)c3c2[nH]n1-c1ccccc1F.
What is the InChIKey of 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
The InChIKey is JBLIPVBOXSMCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9F2N3O/c17-10-4-1-2-7-13(10)21-16(22)9-8-19-12-6-3-5-11(18)14(12)15(9)20-21/h1-8,20H.
What are the key properties of 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one?
9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 297.26 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluoro-2-(2-fluorophenyl)-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 10017510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).