8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one

C26H24N4O3 — CID 155532794

IUPAC8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one
SMILESCOc1ccc(Cn2c(=O)n(C)c3c4cc(-c5cnc(OC)c(C)c5)ccc4ncc32)cc1
InChIInChI=1S/C26H24N4O3/c1-16-11-19(13-28-25(16)33-4)18-7-10-22-21(12-18)24-23(14-27-22)30(26(31)29(24)2)15-17-5-8-20(32-3)9-6-17/h5-14H,15H2,1-4H3
InChIKeyKBKGSCFXRJFRPO-UHFFFAOYSA-N
MW440.50 g/mol
LogP4.32
Rot. Bonds5

About 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one

8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one (PubChem CID 155532794) has the molecular formula C26H24N4O3 and a molecular weight of 440.50 g/mol. Its IUPAC name is 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one
PubChem CID155532794
Molecular FormulaC26H24N4O3
Molecular Weight440.50 g/mol
Exact Mass440.18
IUPAC Name8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one
SMILESCOc1ccc(Cn2c(=O)n(C)c3c4cc(-c5cnc(OC)c(C)c5)ccc4ncc32)cc1
InChIInChI=1S/C26H24N4O3/c1-16-11-19(13-28-25(16)33-4)18-7-10-22-21(12-18)24-23(14-27-22)30(26(31)29(24)2)15-17-5-8-20(32-3)9-6-17/h5-14H,15H2,1-4H3
InChIKeyKBKGSCFXRJFRPO-UHFFFAOYSA-N
XLogP4.32
TPSA71.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.50
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one?
The IUPAC name of 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one (CID 155532794) is 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one is COc1ccc(Cn2c(=O)n(C)c3c4cc(-c5cnc(OC)c(C)c5)ccc4ncc32)cc1.
What is the InChIKey of 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one?
The InChIKey is KBKGSCFXRJFRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O3/c1-16-11-19(13-28-25(16)33-4)18-7-10-22-21(12-18)24-23(14-27-22)30(26(31)29(24)2)15-17-5-8-20(32-3)9-6-17/h5-14H,15H2,1-4H3.
What are the key properties of 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one?
8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one has a molecular weight of 440.50 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-methoxy-5-methyl-3-pyridinyl)-3-[(4-methoxyphenyl)methyl]-1-methylimidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 155532794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).