7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one

C94H108N26O4 — CID 157309057

IUPAC7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one
SMILESCCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(C)[C@H](C)C5)ccc4n3)cc12.CCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(CC)[C@H](C)C5)ccc4n3)cc12.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C(C)C)CC5)ncc4n3)ccc2n1.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C6CCC6)CC5)ncc4n3)ccc2n1
InChIInChI=1S/C24H29N7O.C24H26N6O.C23H27N7O.C23H26N6O/c1-5-19-22-11-21(27-31(22)13-16(3)25-19)20-12-24(32)30-15-18(7-8-23(30)26-20)29-10-9-28(6-2)17(4)14-29;1-16-13-29-14-18(5-6-22(29)26-16)20-11-24(31)30-15-21(25-12-23(30)27-20)17-7-9-28(10-8-17)19-3-2-4-19;1-5-18-21-10-20(26-30(21)12-15(2)24-18)19-11-23(31)29-14-17(6-7-22(29)25-19)28-9-8-27(4)16(3)13-28;1-15(2)27-8-6-17(7-9-27)20-14-29-22(11-24-20)26-19(10-23(29)30)18-4-5-21-25-16(3)12-28(21)13-18/h7-8,11-13,15,17H,5-6,9-10,14H2,1-4H3;5-6,11-15,17,19H,2-4,7-10H2,1H3;6-7,10-12,14,16H,5,8-9,13H2,1-4H3;4-5,10-15,17H,6-9H2,1-3H3/t17-;;16-;/m1.1./s1
InChIKeyBCVCVLLSOWICDA-LDFZINKRSA-N
MW1666.08 g/mol
LogP11.97
Rot. Bonds13

About 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one

7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one (PubChem CID 157309057) has the molecular formula C94H108N26O4 and a molecular weight of 1666.08 g/mol. Its IUPAC name is 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one
PubChem CID157309057
Molecular FormulaC94H108N26O4
Molecular Weight1666.08 g/mol
Exact Mass1664.90
IUPAC Name7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one
SMILESCCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(C)[C@H](C)C5)ccc4n3)cc12.CCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(CC)[C@H](C)C5)ccc4n3)cc12.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C(C)C)CC5)ncc4n3)ccc2n1.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C6CCC6)CC5)ncc4n3)ccc2n1
InChIInChI=1S/C24H29N7O.C24H26N6O.C23H27N7O.C23H26N6O/c1-5-19-22-11-21(27-31(22)13-16(3)25-19)20-12-24(32)30-15-18(7-8-23(30)26-20)29-10-9-28(6-2)17(4)14-29;1-16-13-29-14-18(5-6-22(29)26-16)20-11-24(31)30-15-21(25-12-23(30)27-20)17-7-9-28(10-8-17)19-3-2-4-19;1-5-18-21-10-20(26-30(21)12-15(2)24-18)19-11-23(31)29-14-17(6-7-22(29)25-19)28-9-8-27(4)16(3)13-28;1-15(2)27-8-6-17(7-9-27)20-14-29-22(11-24-20)26-19(10-23(29)30)18-4-5-21-25-16(3)12-28(21)13-18/h7-8,11-13,15,17H,5-6,9-10,14H2,1-4H3;5-6,11-15,17,19H,2-4,7-10H2,1H3;6-7,10-12,14,16H,5,8-9,13H2,1-4H3;4-5,10-15,17H,6-9H2,1-3H3/t17-;;16-;/m1.1./s1
InChIKeyBCVCVLLSOWICDA-LDFZINKRSA-N
XLogP11.97
TPSA277.68 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds13
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001666.08
LogP ≤ 511.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-[[4-[2-[3-[[5-(1-Methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]piperidin-1-yl]pyrimidin-5-yl]phenyl]methyl]piperazin-1-yl]ethanone
CID 118364786
US10730877, Example 773
CID 138686644
US10730877, Example 785
CID 138687003
US10730877, Example 772
CID 138687013
US10730877, Example 767
CID 138722015
US10730877, Example 784
CID 138725447
US10730877, Example 776
CID 138725606
US11111247, Example 21
CID 146448882
US11780845, Example 778
CID 155309043
[4-Fluoro-1-(pyridazin-4-ylmethyl)piperidin-4-yl]-[4-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 10239176
3-[(3R)-3-[[5-fluoro-6-[4-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-4-yl]methyl]piperazin-1-yl]-2-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile
CID 118140606
(3-fluoroimidazo[1,2-a]pyridin-2-yl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyridin-2-yl]piperidin-1-yl]methanone
CID 121324287

Frequently Asked Questions

What is the IUPAC name of 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one (CID 157309057) is 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one is CCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(C)[C@H](C)C5)ccc4n3)cc12.CCc1nc(C)cn2nc(-c3cc(=O)n4cc(N5CCN(CC)[C@H](C)C5)ccc4n3)cc12.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C(C)C)CC5)ncc4n3)ccc2n1.Cc1cn2cc(-c3cc(=O)n4cc(C5CCN(C6CCC6)CC5)ncc4n3)ccc2n1.
What is the InChIKey of 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one?
The InChIKey is BCVCVLLSOWICDA-LDFZINKRSA-N. The full InChI is InChI=1S/C24H29N7O.C24H26N6O.C23H27N7O.C23H26N6O/c1-5-19-22-11-21(27-31(22)13-16(3)25-19)20-12-24(32)30-15-18(7-8-23(30)26-20)29-10-9-28(6-2)17(4)14-29;1-16-13-29-14-18(5-6-22(29)26-16)20-11-24(31)30-15-21(25-12-23(30)27-20)17-7-9-28(10-8-17)19-3-2-4-19;1-5-18-21-10-20(26-30(21)12-15(2)24-18)19-11-23(31)29-14-17(6-7-22(29)25-19)28-9-8-27(4)16(3)13-28;1-15(2)27-8-6-17(7-9-27)20-14-29-22(11-24-20)26-19(10-23(29)30)18-4-5-21-25-16(3)12-28(21)13-18/h7-8,11-13,15,17H,5-6,9-10,14H2,1-4H3;5-6,11-15,17,19H,2-4,7-10H2,1H3;6-7,10-12,14,16H,5,8-9,13H2,1-4H3;4-5,10-15,17H,6-9H2,1-3H3/t17-;;16-;/m1.1./s1.
What are the key properties of 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one?
7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one has a molecular weight of 1666.08 g/mol, XLogP of 11.97, 13 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-cyclobutylpiperidin-4-yl)-2-(2-methylimidazo[1,2-a]pyridin-6-yl)pyrazino[1,2-a]pyrimidin-4-one;7-[(3R)-3,4-dimethylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;7-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-2-(4-ethyl-6-methylpyrazolo[1,5-a]pyrazin-2-yl)pyrido[1,2-a]pyrimidin-4-one;2-(2-methylimidazo[1,2-a]pyridin-6-yl)-7-(1-propan-2-ylpiperidin-4-yl)pyrazino[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 157309057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).