8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one

C16H10ClN3O — CID 10334707

IUPAC8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2cn(-c3ccccc3)nc12
InChIInChI=1S/C16H10ClN3O/c17-10-6-7-14-12(8-10)13-9-20(11-4-2-1-3-5-11)19-15(13)16(21)18-14/h1-9H,(H,18,21)
InChIKeyFPPNVIGLHYPKSL-UHFFFAOYSA-N
MW295.73 g/mol
LogP3.52
Rot. Bonds1

About 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one

8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one (PubChem CID 10334707) has the molecular formula C16H10ClN3O and a molecular weight of 295.73 g/mol. Its IUPAC name is 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one.

Molecular Properties

Compound Name8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one
PubChem CID10334707
Molecular FormulaC16H10ClN3O
Molecular Weight295.73 g/mol
Exact Mass295.05
IUPAC Name8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one
SMILESO=c1[nH]c2ccc(Cl)cc2c2cn(-c3ccccc3)nc12
InChIInChI=1S/C16H10ClN3O/c17-10-6-7-14-12(8-10)13-9-20(11-4-2-1-3-5-11)19-15(13)16(21)18-14/h1-9H,(H,18,21)
InChIKeyFPPNVIGLHYPKSL-UHFFFAOYSA-N
XLogP3.52
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-2H,4H,5H-pyrazolo(3,4-c)quinolin-4-one
CID 4962866
2-benzyl-2H-pyrazolo[3,4-c]quinolin-4(5H)-one
CID 10636110
2-m-tolyl-2H-pyrazolo[3,4-c]quinolin-4(5H)-one
CID 10588437
2-p-tolyl-2H-pyrazolo[3,4-c]quinolin-4(5H)-one
CID 10731097
2-(2-chlorophenyl)-3-(4-chlorophenyl)-5,6-dihydro-4H-pyrazolo[3,4-c]pyridin-7-one
CID 42617975
Hymenialdisine, 28o
CID 135499824
N-[2-(4-chlorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16194125
2-Phenyl-5-propyl-2,5-dihydro-pyrazolo[3,4-c]quinolin-4-one
CID 10804397
5-Methyl-2-phenyl-2,5-dihydro-pyrazolo[3,4-c]quinolin-4-one
CID 10826247
N-[2-(2-chlorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16024956
7-Chloranyl-2-ethyl-5-pyridin-3-yl-pyrazolo[3,4-c]quinolin-4-one
CID 171666122
2-(4-Chlorophenyl)-2,5-dihydropyrazolo[3,4-c]quinolin-4-one
CID 10517992

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one?
The IUPAC name of 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one (CID 10334707) is 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one.
What is the SMILES notation for 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one?
The canonical SMILES for 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one is O=c1[nH]c2ccc(Cl)cc2c2cn(-c3ccccc3)nc12.
What is the InChIKey of 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one?
The InChIKey is FPPNVIGLHYPKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3O/c17-10-6-7-14-12(8-10)13-9-20(11-4-2-1-3-5-11)19-15(13)16(21)18-14/h1-9H,(H,18,21).
What are the key properties of 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one?
8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one has a molecular weight of 295.73 g/mol, XLogP of 3.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one is sourced from PubChem (CID 10334707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).