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

C20H19N7O2 — CID 122599283

IUPAC7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCOc1cc2ncc3c(c2cc1-c1cnn(C)c1)n(-c1cn[nH]c1C)c(=O)n3C
InChIInChI=1S/C20H19N7O2/c1-11-16(9-22-24-11)27-19-14-5-13(12-7-23-25(2)10-12)18(29-4)6-15(14)21-8-17(19)26(3)20(27)28/h5-10H,1-4H3,(H,22,24)
InChIKeyHGNALLHPQVVPFT-UHFFFAOYSA-N
MW389.42 g/mol
LogP2.32
Rot. Bonds3

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

7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (PubChem CID 122599283) has the molecular formula C20H19N7O2 and a molecular weight of 389.42 g/mol. Its IUPAC name is 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
PubChem CID122599283
Molecular FormulaC20H19N7O2
Molecular Weight389.42 g/mol
Exact Mass389.16
IUPAC Name7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCOc1cc2ncc3c(c2cc1-c1cnn(C)c1)n(-c1cn[nH]c1C)c(=O)n3C
InChIInChI=1S/C20H19N7O2/c1-11-16(9-22-24-11)27-19-14-5-13(12-7-23-25(2)10-12)18(29-4)6-15(14)21-8-17(19)26(3)20(27)28/h5-10H,1-4H3,(H,22,24)
InChIKeyHGNALLHPQVVPFT-UHFFFAOYSA-N
XLogP2.32
TPSA95.55 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.42
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

M-4076
CID 122599280
DNA-PK-IN-11
CID 56847587
US11155557, Example 30
CID 138753291
1-[3-methoxy-4-(1H-pyrazol-4-yl)phenyl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one
CID 118239105
3-Fluoro-4-[7-methoxy-3-methyl-8-(2-methylpyrazol-3-yl)-2-oxoimidazo[4,5-c]quinolin-1-yl]benzonitrile
CID 56847640
3-Fluoro-4-[7-methoxy-3-methyl-8-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-oxoimidazo[4,5-c]quinolin-1-yl]benzonitrile
CID 56847642
US10457677, Example 114
CID 122589327
US10457677, Example 129
CID 122589331
US10457677, Example 33
CID 122589364
US10457677, Example 145
CID 122589371
US10457677, Example 119
CID 122589374
US10457677, Example 36
CID 122589382

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (CID 122599283) is 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is COc1cc2ncc3c(c2cc1-c1cnn(C)c1)n(-c1cn[nH]c1C)c(=O)n3C.
What is the InChIKey of 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The InChIKey is HGNALLHPQVVPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O2/c1-11-16(9-22-24-11)27-19-14-5-13(12-7-23-25(2)10-12)18(29-4)6-15(14)21-8-17(19)26(3)20(27)28/h5-10H,1-4H3,(H,22,24).
What are the key properties of 7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
7-methoxy-3-methyl-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one has a molecular weight of 389.42 g/mol, XLogP of 2.32, 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-8-(1-methylpyrazol-4-yl)-1-(5-methyl-1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 122599283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).