7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one

C19H17N7O2 — CID 122589437

IUPAC7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCOc1cc2ncc3c(c2cc1-c1cn[nH]c1)n(-c1cnn(C)c1)c(=O)n3C
InChIInChI=1S/C19H17N7O2/c1-24-10-12(8-23-24)26-18-14-4-13(11-6-21-22-7-11)17(28-3)5-15(14)20-9-16(18)25(2)19(26)27/h4-10H,1-3H3,(H,21,22)
InChIKeyGSFLMJOLTDVILW-UHFFFAOYSA-N
MW375.39 g/mol
LogP2.01
Rot. Bonds3

About 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one

7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (PubChem CID 122589437) has the molecular formula C19H17N7O2 and a molecular weight of 375.39 g/mol. Its IUPAC name is 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
PubChem CID122589437
Molecular FormulaC19H17N7O2
Molecular Weight375.39 g/mol
Exact Mass375.14
IUPAC Name7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCOc1cc2ncc3c(c2cc1-c1cn[nH]c1)n(-c1cnn(C)c1)c(=O)n3C
InChIInChI=1S/C19H17N7O2/c1-24-10-12(8-23-24)26-18-14-4-13(11-6-21-22-7-11)17(28-3)5-15(14)20-9-16(18)25(2)19(26)27/h4-10H,1-3H3,(H,21,22)
InChIKeyGSFLMJOLTDVILW-UHFFFAOYSA-N
XLogP2.01
TPSA95.55 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (CID 122589437) is 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is COc1cc2ncc3c(c2cc1-c1cn[nH]c1)n(-c1cnn(C)c1)c(=O)n3C.
What is the InChIKey of 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The InChIKey is GSFLMJOLTDVILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O2/c1-24-10-12(8-23-24)26-18-14-4-13(11-6-21-22-7-11)17(28-3)5-15(14)20-9-16(18)25(2)19(26)27/h4-10H,1-3H3,(H,21,22).
What are the key properties of 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one has a molecular weight of 375.39 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-methyl-1-(1-methylpyrazol-4-yl)-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 122589437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).