3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one

C88H92N22O8 — CID 162053369

IUPAC3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one
SMILESCCN1CCCN(c2ccc3cc(-c4cn5cc(C)nc(C)c5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5ccccc5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1ccc2nc(-c3cc4ccc(N5C[C@@H]6C[C@H]5CN6C)nc4oc3=O)cn2c1
InChIInChI=1S/C23H26N6O2.C22H21N5O2.C22H23N5O2.C21H22N6O2/c1-4-27-8-5-9-28(11-10-27)20-7-6-17-12-18(23(30)31-22(17)26-20)19-14-29-13-15(2)24-16(3)21(29)25-19;1-13-3-5-19-23-18(12-26(19)9-13)17-7-14-4-6-20(24-21(14)29-22(17)28)27-11-15-8-16(27)10-25(15)2;1-2-25-9-5-11-26(13-12-25)20-8-7-16-14-17(22(28)29-21(16)24-20)18-15-27-10-4-3-6-19(27)23-18;1-2-25-8-4-10-26(12-11-25)18-6-5-15-13-16(20(28)29-19(15)24-18)17-14-27-9-3-7-22-21(27)23-17/h6-7,12-14H,4-5,8-11H2,1-3H3;3-7,9,12,15-16H,8,10-11H2,1-2H3;3-4,6-8,10,14-15H,2,5,9,11-13H2,1H3;3,5-7,9,13-14H,2,4,8,10-12H2,1H3/t;15-,16-;;/m.0../s1
InChIKeyYYVOFAIYLMFCCC-RTQYZQDASA-N
MW1585.85 g/mol
LogP11.21
Rot. Bonds11

About 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one

3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one (PubChem CID 162053369) has the molecular formula C88H92N22O8 and a molecular weight of 1585.85 g/mol. Its IUPAC name is 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one.

Molecular Properties

Compound Name3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one
PubChem CID162053369
Molecular FormulaC88H92N22O8
Molecular Weight1585.85 g/mol
Exact Mass1584.75
IUPAC Name3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one
SMILESCCN1CCCN(c2ccc3cc(-c4cn5cc(C)nc(C)c5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5ccccc5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1ccc2nc(-c3cc4ccc(N5C[C@@H]6C[C@H]5CN6C)nc4oc3=O)cn2c1
InChIInChI=1S/C23H26N6O2.C22H21N5O2.C22H23N5O2.C21H22N6O2/c1-4-27-8-5-9-28(11-10-27)20-7-6-17-12-18(23(30)31-22(17)26-20)19-14-29-13-15(2)24-16(3)21(29)25-19;1-13-3-5-19-23-18(12-26(19)9-13)17-7-14-4-6-20(24-21(14)29-22(17)28)27-11-15-8-16(27)10-25(15)2;1-2-25-9-5-11-26(13-12-25)20-8-7-16-14-17(22(28)29-21(16)24-20)18-15-27-10-4-3-6-19(27)23-18;1-2-25-8-4-10-26(12-11-25)18-6-5-15-13-16(20(28)29-19(15)24-18)17-14-27-9-3-7-22-21(27)23-17/h6-7,12-14H,4-5,8-11H2,1-3H3;3-7,9,12,15-16H,8,10-11H2,1-2H3;3-4,6-8,10,14-15H,2,5,9,11-13H2,1H3;3,5-7,9,13-14H,2,4,8,10-12H2,1H3/t;15-,16-;;/m.0../s1
InChIKeyYYVOFAIYLMFCCC-RTQYZQDASA-N
XLogP11.21
TPSA293.30 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds11
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001585.85
LogP ≤ 511.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one with MolForge

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Launch Full Analysis

Related Compounds

7-[(3S)-3,4-dimethylpiperazin-1-yl]-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one
CID 71730377
3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]pyrano[2,3-b]pyridin-2-one
CID 71730643
hypochlorous acid;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[2,3-b]pyridin-2-one
CID 146191096
7-[(2S)-2,4-dimethylpiperazin-1-yl]-3-(7-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one
CID 71730113
7-(2,4-dimethylpiperazin-1-yl)-3-(7-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one
CID 78161663
7-(1,4-diazepan-1-yl)-5-fluoro-3-imidazo[1,2-a]pyrimidin-2-ylchromen-2-one;3-(6-ethylimidazo[1,2-a]pyridin-2-yl)-7-(4-methyl-1,4-diazepan-1-yl)chromen-2-one;3-(8-ethyl-6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methyl-1,4-diazepan-1-yl)chromen-2-one;3-(8-ethyl-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylchromen-2-one;5-fluoro-3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)chromen-2-one
CID 161036640
3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-[(2S)-2-methylpiperazin-1-yl]pyrano[2,3-b]pyridin-2-one
CID 71732059
3-(4-chloro-1,3-benzothiazol-2-yl)-7-[(3R,5S)-3,5-dimethylpiperazin-1-yl]pyrano[2,3-b]pyridin-2-one;3-(4-chloro-1,3-benzothiazol-2-yl)-7-[(3R,5S)-3,4,5-trimethylpiperazin-1-yl]pyrano[2,3-b]pyridin-2-one;7-[(3S)-3,4-dimethylpiperazin-1-yl]-3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-[(3S)-3-methylpiperazin-1-yl]pyrano[2,3-b]pyridin-2-one
CID 160863616
7-[(3S)-4-(2-aminoethyl)-3-methylpiperazin-1-yl]-3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)chromen-2-one
CID 139460014
3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-3-propan-2-ylpiperazin-1-yl)chromen-2-one
CID 123341802
3-imidazo[1,2-a]pyridin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)chromen-2-one
CID 163611979
3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one
CID 71731522

Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one?
The IUPAC name of 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one (CID 162053369) is 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one.
What is the SMILES notation for 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one?
The canonical SMILES for 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one is CCN1CCCN(c2ccc3cc(-c4cn5cc(C)nc(C)c5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5ccccc5n4)c(=O)oc3n2)CC1.CCN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1ccc2nc(-c3cc4ccc(N5C[C@@H]6C[C@H]5CN6C)nc4oc3=O)cn2c1.
What is the InChIKey of 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one?
The InChIKey is YYVOFAIYLMFCCC-RTQYZQDASA-N. The full InChI is InChI=1S/C23H26N6O2.C22H21N5O2.C22H23N5O2.C21H22N6O2/c1-4-27-8-5-9-28(11-10-27)20-7-6-17-12-18(23(30)31-22(17)26-20)19-14-29-13-15(2)24-16(3)21(29)25-19;1-13-3-5-19-23-18(12-26(19)9-13)17-7-14-4-6-20(24-21(14)29-22(17)28)27-11-15-8-16(27)10-25(15)2;1-2-25-9-5-11-26(13-12-25)20-8-7-16-14-17(22(28)29-21(16)24-20)18-15-27-10-4-3-6-19(27)23-18;1-2-25-8-4-10-26(12-11-25)18-6-5-15-13-16(20(28)29-19(15)24-18)17-14-27-9-3-7-22-21(27)23-17/h6-7,12-14H,4-5,8-11H2,1-3H3;3-7,9,12,15-16H,8,10-11H2,1-2H3;3-4,6-8,10,14-15H,2,5,9,11-13H2,1H3;3,5-7,9,13-14H,2,4,8,10-12H2,1H3/t;15-,16-;;/m.0../s1.
What are the key properties of 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one?
3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one has a molecular weight of 1585.85 g/mol, XLogP of 11.21, 11 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(4-ethyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyridin-2-ylpyrano[2,3-b]pyridin-2-one;7-(4-ethyl-1,4-diazepan-1-yl)-3-imidazo[1,2-a]pyrimidin-2-ylpyrano[2,3-b]pyridin-2-one;7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3-(6-methylimidazo[1,2-a]pyridin-2-yl)pyrano[2,3-b]pyridin-2-one is sourced from PubChem (CID 162053369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).