5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one

C21H16N4O2 — CID 10570239

IUPAC5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one
SMILESCn1c(=O)cc(-n2cc3c(=O)n(C)c4ccccc4c3n2)c2ccccc21
InChIInChI=1S/C21H16N4O2/c1-23-16-9-5-3-7-13(16)18(11-19(23)26)25-12-15-20(22-25)14-8-4-6-10-17(14)24(2)21(15)27/h3-12H,1-2H3
InChIKeyZPEWHTYFSRFAQM-UHFFFAOYSA-N
MW356.39 g/mol
LogP2.73
Rot. Bonds1

About 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one

5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one (PubChem CID 10570239) has the molecular formula C21H16N4O2 and a molecular weight of 356.39 g/mol. Its IUPAC name is 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one
PubChem CID10570239
Molecular FormulaC21H16N4O2
Molecular Weight356.39 g/mol
Exact Mass356.13
IUPAC Name5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one
SMILESCn1c(=O)cc(-n2cc3c(=O)n(C)c4ccccc4c3n2)c2ccccc21
InChIInChI=1S/C21H16N4O2/c1-23-16-9-5-3-7-13(16)18(11-19(23)26)25-12-15-20(22-25)14-8-4-6-10-17(14)24(2)21(15)27/h3-12H,1-2H3
InChIKeyZPEWHTYFSRFAQM-UHFFFAOYSA-N
XLogP2.73
TPSA61.82 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one (CID 10570239) is 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one is Cn1c(=O)cc(-n2cc3c(=O)n(C)c4ccccc4c3n2)c2ccccc21.
What is the InChIKey of 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is ZPEWHTYFSRFAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O2/c1-23-16-9-5-3-7-13(16)18(11-19(23)26)25-12-15-20(22-25)14-8-4-6-10-17(14)24(2)21(15)27/h3-12H,1-2H3.
What are the key properties of 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one?
5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 356.39 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(1-methyl-2-oxoquinolin-4-yl)pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 10570239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).