3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one

C81H78ClN21O8 — CID 158758572

IUPAC3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
SMILESCN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1cc(Cl)c2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCN(C)CC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1
InChIInChI=1S/C21H21N5O2.C20H18ClN5O2.C20H20N6O2.C20H19N5O2/c1-14-3-4-19-23-17(13-26(19)12-14)16-9-15-11-22-20(10-18(15)28-21(16)27)25-7-5-24(2)6-8-25;1-12-6-15(21)19-24-16(11-26(19)10-12)14-7-13-9-23-18(8-17(13)28-20(14)27)25-4-2-22-3-5-25;1-24-7-3-9-25(11-10-24)17-5-4-14-12-15(19(27)28-18(14)23-17)16-13-26-8-2-6-21-20(26)22-16;1-13-2-3-18-23-16(12-25(18)11-13)15-8-14-10-22-19(9-17(14)27-20(15)26)24-6-4-21-5-7-24/h3-4,9-13H,5-8H2,1-2H3;6-11,22H,2-5H2,1H3;2,4-6,8,12-13H,3,7,9-11H2,1H3;2-3,8-12,21H,4-7H2,1H3
InChIKeyIOJNECXTAJPZHT-UHFFFAOYSA-N
MW1509.11 g/mol
LogP9.70
Rot. Bonds8

About 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one

3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one (PubChem CID 158758572) has the molecular formula C81H78ClN21O8 and a molecular weight of 1509.11 g/mol. Its IUPAC name is 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one.

Molecular Properties

Compound Name3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
PubChem CID158758572
Molecular FormulaC81H78ClN21O8
Molecular Weight1509.11 g/mol
Exact Mass1507.60
IUPAC Name3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
SMILESCN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1cc(Cl)c2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCN(C)CC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1
InChIInChI=1S/C21H21N5O2.C20H18ClN5O2.C20H20N6O2.C20H19N5O2/c1-14-3-4-19-23-17(13-26(19)12-14)16-9-15-11-22-20(10-18(15)28-21(16)27)25-7-5-24(2)6-8-25;1-12-6-15(21)19-24-16(11-26(19)10-12)14-7-13-9-23-18(8-17(13)28-20(14)27)25-4-2-22-3-5-25;1-24-7-3-9-25(11-10-24)17-5-4-14-12-15(19(27)28-18(14)23-17)16-13-26-8-2-6-21-20(26)22-16;1-13-2-3-18-23-16(12-25(18)11-13)15-8-14-10-22-19(9-17(14)27-20(15)26)24-6-4-21-5-7-24/h3-4,9-13H,5-8H2,1-2H3;6-11,22H,2-5H2,1H3;2,4-6,8,12-13H,3,7,9-11H2,1H3;2-3,8-12,21H,4-7H2,1H3
InChIKeyIOJNECXTAJPZHT-UHFFFAOYSA-N
XLogP9.70
TPSA297.99 Ų
H-Bond Donors2
H-Bond Acceptors29
Rotatable Bonds8
Heavy Atoms111
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001509.11
LogP ≤ 59.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1029

Analyze 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The IUPAC name of 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one (CID 158758572) is 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one.
What is the SMILES notation for 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The canonical SMILES for 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one is CN1CCCN(c2ccc3cc(-c4cn5cccnc5n4)c(=O)oc3n2)CC1.Cc1cc(Cl)c2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCN(C)CC5)cc4oc3=O)cn2c1.Cc1ccc2nc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)cn2c1.
What is the InChIKey of 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The InChIKey is IOJNECXTAJPZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O2.C20H18ClN5O2.C20H20N6O2.C20H19N5O2/c1-14-3-4-19-23-17(13-26(19)12-14)16-9-15-11-22-20(10-18(15)28-21(16)27)25-7-5-24(2)6-8-25;1-12-6-15(21)19-24-16(11-26(19)10-12)14-7-13-9-23-18(8-17(13)28-20(14)27)25-4-2-22-3-5-25;1-24-7-3-9-25(11-10-24)17-5-4-14-12-15(19(27)28-18(14)23-17)16-13-26-8-2-6-21-20(26)22-16;1-13-2-3-18-23-16(12-25(18)11-13)15-8-14-10-22-19(9-17(14)27-20(15)26)24-6-4-21-5-7-24/h3-4,9-13H,5-8H2,1-2H3;6-11,22H,2-5H2,1H3;2,4-6,8,12-13H,3,7,9-11H2,1H3;2-3,8-12,21H,4-7H2,1H3.
What are the key properties of 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one has a molecular weight of 1509.11 g/mol, XLogP of 9.70, 8 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one;3-imidazo[1,2-a]pyrimidin-2-yl-7-(4-methyl-1,4-diazepan-1-yl)pyrano[2,3-b]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-(4-methylpiperazin-1-yl)pyrano[3,2-c]pyridin-2-one;3-(6-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one is sourced from PubChem (CID 158758572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).