1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate

C71H74N14O9 — CID 161246511

IUPAC1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate
SMILESCOC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(OC)nc5)cc4c32)CC1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCCCC2)c(=O)n4C)cn1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cn1
InChIInChI=1S/C24H25N5O4.C24H25N5O3.C23H24N4O2/c1-27-20-14-25-19-6-4-15(16-5-7-21(32-2)26-13-16)12-18(19)22(20)29(23(27)30)17-8-10-28(11-9-17)24(31)33-3;1-15(30)28-10-8-18(9-11-28)29-23-19-12-16(17-5-7-22(32-3)26-13-17)4-6-20(19)25-14-21(23)27(2)24(29)31;1-26-20-14-24-19-10-8-15(16-9-11-21(29-2)25-13-16)12-18(19)22(20)27(23(26)28)17-6-4-3-5-7-17/h4-7,12-14,17H,8-11H2,1-3H3;4-7,12-14,18H,8-11H2,1-3H3;8-14,17H,3-7H2,1-2H3
InChIKeyVARZPGXFOQCOBM-UHFFFAOYSA-N
MW1267.46 g/mol
LogP10.97
Rot. Bonds9

About 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate

1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate (PubChem CID 161246511) has the molecular formula C71H74N14O9 and a molecular weight of 1267.46 g/mol. Its IUPAC name is 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate.

Molecular Properties

Compound Name1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate
PubChem CID161246511
Molecular FormulaC71H74N14O9
Molecular Weight1267.46 g/mol
Exact Mass1266.58
IUPAC Name1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate
SMILESCOC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(OC)nc5)cc4c32)CC1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCCCC2)c(=O)n4C)cn1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cn1
InChIInChI=1S/C24H25N5O4.C24H25N5O3.C23H24N4O2/c1-27-20-14-25-19-6-4-15(16-5-7-21(32-2)26-13-16)12-18(19)22(20)29(23(27)30)17-8-10-28(11-9-17)24(31)33-3;1-15(30)28-10-8-18(9-11-28)29-23-19-12-16(17-5-7-22(32-3)26-13-17)4-6-20(19)25-14-21(23)27(2)24(29)31;1-26-20-14-24-19-10-8-15(16-9-11-21(29-2)25-13-16)12-18(19)22(20)27(23(26)28)17-6-4-3-5-7-17/h4-7,12-14,17H,8-11H2,1-3H3;4-7,12-14,18H,8-11H2,1-3H3;8-14,17H,3-7H2,1-2H3
InChIKeyVARZPGXFOQCOBM-UHFFFAOYSA-N
XLogP10.97
TPSA235.67 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds9
Heavy Atoms94
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001267.46
LogP ≤ 510.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

Azd-0156
CID 118502708
Azd-1390
CID 126689157
1-(1-Acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one
CID 58379543
8-[6-[3-(Dimethylamino)propoxy]-3-pyridinyl]-7-fluoro-3-methyl-1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-one
CID 118498683
1-(3-Methoxycyclobutyl)-3-methyl-8-[6-(3-pyrrolidin-1-ylpropoxy)-3-pyridinyl]imidazo[4,5-c]quinolin-2-one
CID 118500097
1-(3-Methoxycyclobutyl)-3-methyl-8-[6-(3-piperidin-1-ylpropoxy)-3-pyridinyl]imidazo[4,5-c]quinolin-2-one
CID 118502895
7-fluoro-3-methyl-1-[(3S)-oxan-3-yl]-8-[6-(3-piperidin-1-ylpropoxy)-3-pyridinyl]imidazo[4,5-c]quinolin-2-one
CID 118523411
8-(6-Methoxy-3-pyridinyl)-3-methyl-1-[4-[3-(trifluoromethyl)piperazin-1-yl]phenyl]imidazo[4,5-c]quinolin-2-one
CID 133053811
7-Fluoro-3-methyl-8-[6-[3-(1-piperidyl)propoxy]-3-pyridyl]-1-tetrahydropyran-4-yl-imidazo[4,5-c]quinolin-2-one
CID 118523423
3-Methyl-1-propan-2-yl-8-[6-(3-pyrrolidin-1-ylpropoxy)-3-pyridinyl]imidazo[4,5-c]quinolin-2-one
CID 126689144
8-[6-[3-(Dimethylamino)propoxy]-3-pyridinyl]-3-methyl-1-propan-2-ylimidazo[4,5-c]quinolin-2-one
CID 126689215
N,N-dimethyl-3-[[5-[3-methyl-1-(oxan-4-yl)-2-oxoimidazo[4,5-c]quinolin-8-yl]-2-pyridinyl]oxy]propan-1-amine oxide
CID 131986481

Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate?
The IUPAC name of 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate (CID 161246511) is 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate.
What is the SMILES notation for 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate?
The canonical SMILES for 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate is COC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(OC)nc5)cc4c32)CC1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCCCC2)c(=O)n4C)cn1.COc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cn1.
What is the InChIKey of 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate?
The InChIKey is VARZPGXFOQCOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O4.C24H25N5O3.C23H24N4O2/c1-27-20-14-25-19-6-4-15(16-5-7-21(32-2)26-13-16)12-18(19)22(20)29(23(27)30)17-8-10-28(11-9-17)24(31)33-3;1-15(30)28-10-8-18(9-11-28)29-23-19-12-16(17-5-7-22(32-3)26-13-17)4-6-20(19)25-14-21(23)27(2)24(29)31;1-26-20-14-24-19-10-8-15(16-9-11-21(29-2)25-13-16)12-18(19)22(20)27(23(26)28)17-6-4-3-5-7-17/h4-7,12-14,17H,8-11H2,1-3H3;4-7,12-14,18H,8-11H2,1-3H3;8-14,17H,3-7H2,1-2H3.
What are the key properties of 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate?
1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate has a molecular weight of 1267.46 g/mol, XLogP of 10.97, 9 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpiperidin-4-yl)-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;1-cyclohexyl-8-(6-methoxy-3-pyridinyl)-3-methylimidazo[4,5-c]quinolin-2-one;methyl 4-[8-(6-methoxy-3-pyridinyl)-3-methyl-2-oxoimidazo[4,5-c]quinolin-1-yl]piperidine-1-carboxylate is sourced from PubChem (CID 161246511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).