2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one

C18H15N3O2 — CID 5273071

IUPAC2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESCOc1ccc(-n2[nH]c3c(cnc4ccc(C)cc43)c2=O)cc1
InChIInChI=1S/C18H15N3O2/c1-11-3-8-16-14(9-11)17-15(10-19-16)18(22)21(20-17)12-4-6-13(23-2)7-5-12/h3-10,20H,1-2H3
InChIKeyMBZQXGDKLGYJDW-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.18
Rot. Bonds2

About 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one

2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 5273071) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
PubChem CID5273071
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one
SMILESCOc1ccc(-n2[nH]c3c(cnc4ccc(C)cc43)c2=O)cc1
InChIInChI=1S/C18H15N3O2/c1-11-3-8-16-14(9-11)17-15(10-19-16)18(22)21(20-17)12-4-6-13(23-2)7-5-12/h3-10,20H,1-2H3
InChIKeyMBZQXGDKLGYJDW-UHFFFAOYSA-N
XLogP3.18
TPSA59.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

PZ-II-029
CID 10426200
2-(1H-indol-3-yl)-N-(4-methoxyphenyl)-2-oxoacetamide
CID 5315108
8-Chloro-2-(4-methoxy-phenyl)-2,5-dihydro-pyrazolo[4,3-c]quinolin-3-one
CID 10471587
CID 139030520
CID 139030520
2,5-Dihydro-2-(4-methoxyphenyl)-3H-pyrazolo(4,3-c)quinolin-3-one
CID 100812
8-Methyl-2-phenyl-2,5-dihydro-pyrazolo-(4,3-c)quinolin-3-one
CID 5273070
8-bromo-2-(4-methoxyphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 9951236
3-{4-[4-(4-Methoxy-phenyl)-piperazin-1-yl]-butyl}-1H-indole-5-carboxylic acid amide
CID 9978693
8-Methoxy-2-phenyl-2,5-dihydro-pyrazolo-(4,3-c)quinolin-3-one
CID 10039909
7-Methoxy-2-phenyl-2,5-dihydro-pyrazolo[4,3-c]quinolin-3-one
CID 10424361
2-(4-fluorophenyl)-8-methoxy-1H-pyrazolo[4,3-c]quinolin-3-one
CID 13093687
2-(4-Methoxy-phenyl)-2,5,6,7,8,9-hexahydro-pyrazolo[4,3-c]quinolin-3-one
CID 13713251

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The IUPAC name of 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one (CID 5273071) is 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The canonical SMILES for 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one is COc1ccc(-n2[nH]c3c(cnc4ccc(C)cc43)c2=O)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
The InChIKey is MBZQXGDKLGYJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-11-3-8-16-14(9-11)17-15(10-19-16)18(22)21(20-17)12-4-6-13(23-2)7-5-12/h3-10,20H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one?
2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 305.34 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-8-methyl-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 5273071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).