1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one

C25H20N6O3 — CID 59612928

IUPAC1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one
SMILESCOc1ccc(-n2c(=O)n(C)c3cnc4ccc(-c5ccc6nccn6c5)cc4c32)c(OC)n1
InChIInChI=1S/C25H20N6O3/c1-29-20-13-27-18-6-4-15(16-5-8-21-26-10-11-30(21)14-16)12-17(18)23(20)31(25(29)32)19-7-9-22(33-2)28-24(19)34-3/h4-14H,1-3H3
InChIKeyGGKQARIYIOVPPF-UHFFFAOYSA-N
MW452.47 g/mol
LogP3.60
Rot. Bonds4

About 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one

1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one (PubChem CID 59612928) has the molecular formula C25H20N6O3 and a molecular weight of 452.47 g/mol. Its IUPAC name is 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one
PubChem CID59612928
Molecular FormulaC25H20N6O3
Molecular Weight452.47 g/mol
Exact Mass452.16
IUPAC Name1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one
SMILESCOc1ccc(-n2c(=O)n(C)c3cnc4ccc(-c5ccc6nccn6c5)cc4c32)c(OC)n1
InChIInChI=1S/C25H20N6O3/c1-29-20-13-27-18-6-4-15(16-5-8-21-26-10-11-30(21)14-16)12-17(18)23(20)31(25(29)32)19-7-9-22(33-2)28-24(19)34-3/h4-14H,1-3H3
InChIKeyGGKQARIYIOVPPF-UHFFFAOYSA-N
XLogP3.60
TPSA88.47 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.47
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

1-(2,6-dimethoxy-3-pyridinyl)-8-[6-(hydroxymethyl)-5-methoxy-3-pyridinyl]-3-methylimidazo[4,5-c]quinolin-2-one
CID 59612983
8-(6-ethoxy-3-pyridinyl)-1-(2-methoxy-6-piperazin-1-yl-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one
CID 59613060
1-(4-methoxyphenyl)-3-methyl-8-thiophen-3-ylimidazo[4,5-c]quinolin-2-one
CID 134438123
1-(3-chloro-1-methylpyrazol-4-yl)-8-(2-methoxypyrimidin-5-yl)-3-methylimidazo[4,5-c]quinolin-2-one
CID 59619918
8-(6-methoxy-3-pyridinyl)-3-methyl-1-[4-pyrazol-1-yl-3-(trifluoromethyl)phenyl]imidazo[4,5-c]quinolin-2-one
CID 11977654
5-[1-(1,3-dimethylpyrazol-4-yl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-8-yl]-2-methoxypyridine-3-carbonitrile
CID 59619935
1-(2,6-dimethoxy-3-pyridinyl)-8-[2-(dimethylamino)pyrimidin-5-yl]-3H-imidazo[4,5-c]quinolin-2-one
CID 70212828
1-(1-ethyl-3-methylpyrazol-4-yl)-8-(2-methoxypyrimidin-5-yl)-3-methylimidazo[4,5-c]quinolin-2-one
CID 59619745
1-(6-fluoro-2-methyl-3-pyridinyl)-8-[6-(hydroxymethyl)-5-methoxy-3-pyridinyl]-3-methylimidazo[4,5-c]quinolin-2-one
CID 59613089
8-[6-amino-5-(trifluoromethyl)-3-pyridinyl]-1-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one
CID 57344810
1-(2-ethylphenyl)-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
CID 11978091
1-(1,3-dimethylpyrazol-4-yl)-8-[6-(ethoxymethyl)-5-methoxy-3-pyridinyl]-3-methylimidazo[4,5-c]quinolin-2-one
CID 59619881

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one?
The IUPAC name of 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one (CID 59612928) is 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one is COc1ccc(-n2c(=O)n(C)c3cnc4ccc(-c5ccc6nccn6c5)cc4c32)c(OC)n1.
What is the InChIKey of 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one?
The InChIKey is GGKQARIYIOVPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N6O3/c1-29-20-13-27-18-6-4-15(16-5-8-21-26-10-11-30(21)14-16)12-17(18)23(20)31(25(29)32)19-7-9-22(33-2)28-24(19)34-3/h4-14H,1-3H3.
What are the key properties of 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one?
1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one has a molecular weight of 452.47 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethoxy-3-pyridinyl)-8-imidazo[1,2-a]pyridin-6-yl-3-methylimidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 59612928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).