3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one

C18H17N5O3 — CID 135599954

IUPAC3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one
SMILESCOc1cc2[nH]c(=O)c3c(N)n(-c4cnccc4C)nc3c2cc1OC
InChIInChI=1S/C18H17N5O3/c1-9-4-5-20-8-12(9)23-17(19)15-16(22-23)10-6-13(25-2)14(26-3)7-11(10)21-18(15)24/h4-8H,19H2,1-3H3,(H,21,24)
InChIKeyRKACTEWAHNYEIE-UHFFFAOYSA-N
MW351.37 g/mol
LogP2.17
Rot. Bonds3

About 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one

3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 135599954) has the molecular formula C18H17N5O3 and a molecular weight of 351.37 g/mol. Its IUPAC name is 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one
PubChem CID135599954
Molecular FormulaC18H17N5O3
Molecular Weight351.37 g/mol
Exact Mass351.13
IUPAC Name3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one
SMILESCOc1cc2[nH]c(=O)c3c(N)n(-c4cnccc4C)nc3c2cc1OC
InChIInChI=1S/C18H17N5O3/c1-9-4-5-20-8-12(9)23-17(19)15-16(22-23)10-6-13(25-2)14(26-3)7-11(10)21-18(15)24/h4-8H,19H2,1-3H3,(H,21,24)
InChIKeyRKACTEWAHNYEIE-UHFFFAOYSA-N
XLogP2.17
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one 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

3-amino-2-(5-methoxy-2-methyl-4-pyridin-3-yloxyphenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599934
3-amino-2-(2,4-dichloro-5-methoxyphenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599898
3-amino-7,9-dimethoxy-2-(2-methyl-4-phenoxyphenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135600019
3-amino-7-methoxy-9-(2-methoxyethoxy)-2-(2-methylphenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599922
3-amino-2-[5-(2-hydroxyethoxy)-2-methylphenyl]-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599862
3-amino-2-[4-(2-hydroxyphenoxy)-2-methylphenyl]-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599876
4-[[3-amino-7-methoxy-2-(2-methylphenyl)-4-oxo-5H-pyrazolo[4,3-c]quinolin-9-yl]oxy]-N-methylbutanamide
CID 135600007
3-amino-2-(2,5-difluorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135599933
3-amino-2-[4-phenoxy-2-(trifluoromethyl)phenyl]-5H-pyrazolo[4,3-c]quinolin-4-one
CID 135600024
1-[3,4,5-trimethoxy-2-(4-methoxy-3-methylphenyl)phenyl]-3H-imidazo[4,5-c]pyridin-2-one
CID 175345832
3-amino-2-(5-methoxy-2-methyl-4-phenoxyphenyl)-1,5-dihydropyrazolo[4,3-c]quinoline-4,7-dione
CID 23153976
3-fluoro-6,7-dimethoxy-4-methyl-1H-quinolin-2-one
CID 141228564

Frequently Asked Questions

What is the IUPAC name of 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one (CID 135599954) is 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one is COc1cc2[nH]c(=O)c3c(N)n(-c4cnccc4C)nc3c2cc1OC.
What is the InChIKey of 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is RKACTEWAHNYEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O3/c1-9-4-5-20-8-12(9)23-17(19)15-16(22-23)10-6-13(25-2)14(26-3)7-11(10)21-18(15)24/h4-8H,19H2,1-3H3,(H,21,24).
What are the key properties of 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 351.37 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-7,8-dimethoxy-2-(4-methyl-3-pyridinyl)-5H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 135599954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).