7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one

C18H15ClN4O — CID 172525162

IUPAC7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one
SMILESCCn1cc2c(n1)c(=O)n(-c1cccnc1C)c1cc(Cl)ccc21
InChIInChI=1S/C18H15ClN4O/c1-3-22-10-14-13-7-6-12(19)9-16(13)23(18(24)17(14)21-22)15-5-4-8-20-11(15)2/h4-10H,3H2,1-2H3
InChIKeyLVOJWAIFRVOBSL-UHFFFAOYSA-N
MW338.80 g/mol
LogP3.72
Rot. Bonds2

About 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one

7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one (PubChem CID 172525162) has the molecular formula C18H15ClN4O and a molecular weight of 338.80 g/mol. Its IUPAC name is 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one.

Molecular Properties

Compound Name7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one
PubChem CID172525162
Molecular FormulaC18H15ClN4O
Molecular Weight338.80 g/mol
Exact Mass338.09
IUPAC Name7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one
SMILESCCn1cc2c(n1)c(=O)n(-c1cccnc1C)c1cc(Cl)ccc21
InChIInChI=1S/C18H15ClN4O/c1-3-22-10-14-13-7-6-12(19)9-16(13)23(18(24)17(14)21-22)15-5-4-8-20-11(15)2/h4-10H,3H2,1-2H3
InChIKeyLVOJWAIFRVOBSL-UHFFFAOYSA-N
XLogP3.72
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.80
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-chloro-1-(2-methyl-3-pyridinyl)quinazoline-2,4-dione
CID 170271414
7-chloro-5-pyridin-3-yl-2-(pyridin-3-ylmethyl)pyrazolo[3,4-c]quinolin-4-one
CID 172525205
7-cyclopropyl-8-fluoro-2-methyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c][1,8]naphthyridin-4-one
CID 172525248
7-chloro-5-(2-cyclopropyl-3-pyridinyl)-2-methyl-4-oxopyrazolo[3,4-c]quinoline-8-carbonitrile
CID 172525129
N-[3-[7-chloro-3-(4-chlorophenyl)sulfonyl-2,4-dioxoquinazolin-1-yl]-2-pyridinyl]acetamide
CID 22442378
7-chloro-5-(1H-indazol-4-yl)-4-oxo-2-(pyridin-3-ylmethyl)pyrazolo[3,4-c]quinoline-8-carbonitrile
CID 172525252
6-chloro-2-[2-(2-fluorophenyl)ethenyl]-3-(2-methyl-3-pyridinyl)quinazolin-4-one
CID 54092688
7-chloro-5-methoxy-1-(2-methyl-3-pyridinyl)quinazoline-2,4-dione
CID 170271302
7-chloro-5-(2-chlorophenyl)-2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-one
CID 170551441
methyl 4-amino-7-bromo-1-(2-methyl-3-pyridinyl)-2-oxoquinoline-3-carboxylate
CID 169206986
5-(5,6-difluorobenzotriazol-2-yl)-6-methyl-3-(2-methyl-3-pyridinyl)-1H-pyrimidine-2,4-dione
CID 178059032
7-chloro-2-methyl-5-[(1R)-1-(1H-pyrazol-5-yl)ethyl]pyrazolo[3,4-c]quinolin-4-one
CID 172525507

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one?
The IUPAC name of 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one (CID 172525162) is 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one.
What is the SMILES notation for 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one?
The canonical SMILES for 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one is CCn1cc2c(n1)c(=O)n(-c1cccnc1C)c1cc(Cl)ccc21.
What is the InChIKey of 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one?
The InChIKey is LVOJWAIFRVOBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN4O/c1-3-22-10-14-13-7-6-12(19)9-16(13)23(18(24)17(14)21-22)15-5-4-8-20-11(15)2/h4-10H,3H2,1-2H3.
What are the key properties of 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one?
7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one has a molecular weight of 338.80 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-ethyl-5-(2-methyl-3-pyridinyl)pyrazolo[3,4-c]quinolin-4-one is sourced from PubChem (CID 172525162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).