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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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).