5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine

C104H129F3N24 — CID 158453921

IUPAC5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCCN1CCN(c2cccc3nc([C@H]4CCC[C@@H](c5ncccc5C)N4C)cn23)CC1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C(C)C)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(CC(F)(F)F)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3ccccc3n2)N1Cc1ccccc1-n1cccn1
InChIInChI=1S/C28H28N6.C26H36N6.C25H31F3N6.C25H34N6/c1-21-9-7-15-29-28(21)26-13-6-12-25(23-20-32-17-5-4-14-27(32)31-23)33(26)19-22-10-2-3-11-24(22)34-18-8-16-30-34;1-19(2)30-14-16-31(17-15-30)25-12-6-11-24-28-21(18-32(24)25)22-9-5-10-23(29(22)4)26-20(3)8-7-13-27-26;1-18-6-5-11-29-24(18)21-8-3-7-20(31(21)2)19-16-34-22(30-19)9-4-10-23(34)33-14-12-32(13-15-33)17-25(26,27)28;1-4-29-14-16-30(17-15-29)24-12-6-11-23-27-20(18-31(23)24)21-9-5-10-22(28(21)3)25-19(2)8-7-13-26-25/h2-5,7-11,14-18,20,25-26H,6,12-13,19H2,1H3;6-8,11-13,18-19,22-23H,5,9-10,14-17H2,1-4H3;4-6,9-11,16,20-21H,3,7-8,12-15,17H2,1-2H3;6-8,11-13,18,21-22H,4-5,9-10,14-17H2,1-3H3/t25-,26+;22-,23+;20-,21+;21-,22+/m1111/s1
InChIKeyHEIKOLPMSAHLBL-QADGYUEYSA-N
MW1772.34 g/mol
LogP18.86
Rot. Bonds17

About 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine

5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine (PubChem CID 158453921) has the molecular formula C104H129F3N24 and a molecular weight of 1772.34 g/mol. Its IUPAC name is 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine
PubChem CID158453921
Molecular FormulaC104H129F3N24
Molecular Weight1772.34 g/mol
Exact Mass1771.08
IUPAC Name5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCCN1CCN(c2cccc3nc([C@H]4CCC[C@@H](c5ncccc5C)N4C)cn23)CC1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C(C)C)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(CC(F)(F)F)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3ccccc3n2)N1Cc1ccccc1-n1cccn1
InChIInChI=1S/C28H28N6.C26H36N6.C25H31F3N6.C25H34N6/c1-21-9-7-15-29-28(21)26-13-6-12-25(23-20-32-17-5-4-14-27(32)31-23)33(26)19-22-10-2-3-11-24(22)34-18-8-16-30-34;1-19(2)30-14-16-31(17-15-30)25-12-6-11-24-28-21(18-32(24)25)22-9-5-10-23(29(22)4)26-20(3)8-7-13-27-26;1-18-6-5-11-29-24(18)21-8-3-7-20(31(21)2)19-16-34-22(30-19)9-4-10-23(34)33-14-12-32(13-15-33)17-25(26,27)28;1-4-29-14-16-30(17-15-29)24-12-6-11-23-27-20(18-31(23)24)21-9-5-10-22(28(21)3)25-19(2)8-7-13-26-25/h2-5,7-11,14-18,20,25-26H,6,12-13,19H2,1H3;6-8,11-13,18-19,22-23H,5,9-10,14-17H2,1-4H3;4-6,9-11,16,20-21H,3,7-8,12-15,17H2,1-2H3;6-8,11-13,18,21-22H,4-5,9-10,14-17H2,1-3H3/t25-,26+;22-,23+;20-,21+;21-,22+/m1111/s1
InChIKeyHEIKOLPMSAHLBL-QADGYUEYSA-N
XLogP18.86
TPSA170.98 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds17
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001772.34
LogP ≤ 518.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

2-[[4-[[2-(2-Fluorophenyl)imidazo[4,5-c]pyridin-5-yl]methyl]triazol-1-yl]methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 145968901
2-[[4-[[2-(2-Fluorophenyl)imidazo[4,5-c]pyridin-5-yl]methyl]triazol-1-yl]methyl]-5,7-dimethylimidazo[1,2-a]pyrimidine
CID 145970805
4-[4-[5-[(4-Fluorophenyl)methyl]pyrimidin-2-yl]piperazin-1-yl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 118032848
US9725449, Example 264
CID 122686605
7-(4-fluoro-1H-pyrazol-1-yl)-2-((3-fluoropyridin-2-yl)methyl)-8-(3-methylimidazo[l,2-a]pyridin-6-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 146490623
7-(3-fluoro-1H-pyrazol-1-yl)-2-((3-fluoropyridin-2-yl)methyl)-8-(3-methylimidazo[l,2-a]pyridin-6-yl)-[l,2,4]triazolo[l,5-c]pyrimidin-5-amine
CID 146490629
(S)-7-(4-fluorophenyl)-8-(3-methylimidazo[1,2-a] pyridin-6-yl)-2-((l-methylpyrrolidin-2-yl)methyl)-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 146490652
2-(2,6-Difluorobenzyl)-8-(3-methylimidazo[l,2-a] pyridin-6-yl)-7-(pyrrolidin-1-yl)-[1,2,4]triazolo [1,5-c]pyrimidin-5-amine
CID 146490653
(R)-7-(4-fluorophenyl)-8-(3-methylimidazo[l,2-a]pyrdin-6-yl)-2-((1-methylpyrrolidin-2-yl)meth yl)-[l,2,4]triazolo[l,5-c]pyrimidin-5-amine
CID 146490656
7-(4-Fluorophenyl)-2-((3-fluoropyridin-2-yl) methyl)-8-(imidazo[1,2-a]pyridin-6-yl)-[1,2,4]triazolo [1,5-c]pyrimidin-5-amine
CID 146490845
4-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]pyrimidin-2-amine
CID 155543174
5,8-Dimethyl-2-(2-phenyl-6-(pyrrolidin-1-yl)imidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine
CID 71153171

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine (CID 158453921) is 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine is CCN1CCN(c2cccc3nc([C@H]4CCC[C@@H](c5ncccc5C)N4C)cn23)CC1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C(C)C)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(CC(F)(F)F)CC4)cccc3n2)N1C.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3ccccc3n2)N1Cc1ccccc1-n1cccn1.
What is the InChIKey of 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine?
The InChIKey is HEIKOLPMSAHLBL-QADGYUEYSA-N. The full InChI is InChI=1S/C28H28N6.C26H36N6.C25H31F3N6.C25H34N6/c1-21-9-7-15-29-28(21)26-13-6-12-25(23-20-32-17-5-4-14-27(32)31-23)33(26)19-22-10-2-3-11-24(22)34-18-8-16-30-34;1-19(2)30-14-16-31(17-15-30)25-12-6-11-24-28-21(18-32(24)25)22-9-5-10-23(29(22)4)26-20(3)8-7-13-27-26;1-18-6-5-11-29-24(18)21-8-3-7-20(31(21)2)19-16-34-22(30-19)9-4-10-23(34)33-14-12-32(13-15-33)17-25(26,27)28;1-4-29-14-16-30(17-15-29)24-12-6-11-23-27-20(18-31(23)24)21-9-5-10-22(28(21)3)25-19(2)8-7-13-26-25/h2-5,7-11,14-18,20,25-26H,6,12-13,19H2,1H3;6-8,11-13,18-19,22-23H,5,9-10,14-17H2,1-4H3;4-6,9-11,16,20-21H,3,7-8,12-15,17H2,1-2H3;6-8,11-13,18,21-22H,4-5,9-10,14-17H2,1-3H3/t25-,26+;22-,23+;20-,21+;21-,22+/m1111/s1.
What are the key properties of 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine?
5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine has a molecular weight of 1772.34 g/mol, XLogP of 18.86, 17 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-(4-propan-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine;2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 158453921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).