5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

C77H100N18 — CID 145424740

IUPAC5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C)C5(CC5)C4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C5CC5)CC4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCNC5(CC5)C4)n3c2C)N1
InChIInChI=1S/2C26H34N6.C25H32N6/c1-18-7-6-14-27-24(18)20-8-4-9-21(28-20)25-19(2)32-22(29-25)10-5-11-23(32)31-16-15-30(3)26(17-31)12-13-26;1-18-6-5-13-27-25(18)21-7-3-8-22(28-21)26-19(2)32-23(29-26)9-4-10-24(32)31-16-14-30(15-17-31)20-11-12-20;1-17-6-5-13-26-23(17)19-7-3-8-20(28-19)24-18(2)31-21(29-24)9-4-10-22(31)30-15-14-27-25(16-30)11-12-25/h5-7,10-11,14,20-21,28H,4,8-9,12-13,15-17H2,1-3H3;4-6,9-10,13,20-22,28H,3,7-8,11-12,14-17H2,1-2H3;4-6,9-10,13,19-20,27-28H,3,7-8,11-12,14-16H2,1-2H3
InChIKeyJCYIDTYYBTZYLE-UHFFFAOYSA-N
MW1277.77 g/mol
LogP12.22
Rot. Bonds10

About 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (PubChem CID 145424740) has the molecular formula C77H100N18 and a molecular weight of 1277.77 g/mol. Its IUPAC name is 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
PubChem CID145424740
Molecular FormulaC77H100N18
Molecular Weight1277.77 g/mol
Exact Mass1276.84
IUPAC Name5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C)C5(CC5)C4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C5CC5)CC4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCNC5(CC5)C4)n3c2C)N1
InChIInChI=1S/2C26H34N6.C25H32N6/c1-18-7-6-14-27-24(18)20-8-4-9-21(28-20)25-19(2)32-22(29-25)10-5-11-23(32)31-16-15-30(3)26(17-31)12-13-26;1-18-6-5-13-27-25(18)21-7-3-8-22(28-21)26-19(2)32-23(29-26)9-4-10-24(32)31-16-14-30(15-17-31)20-11-12-20;1-17-6-5-13-26-23(17)19-7-3-8-20(28-19)24-18(2)31-21(29-24)9-4-10-22(31)30-15-14-27-25(16-30)11-12-25/h5-7,10-11,14,20-21,28H,4,8-9,12-13,15-17H2,1-3H3;4-6,9-10,13,20-22,28H,3,7-8,11-12,14-17H2,1-2H3;4-6,9-10,13,19-20,27-28H,3,7-8,11-12,14-16H2,1-2H3
InChIKeyJCYIDTYYBTZYLE-UHFFFAOYSA-N
XLogP12.22
TPSA154.89 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds10
Heavy Atoms95
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001277.77
LogP ≤ 512.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Analyze 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

9-Cyclopentyl-N-(5-Piperazin-1-Ylpyridin-2-Yl)pyrido[4,5]pyrrolo[1,2-D]pyrimidin-2-Amine
CID 44132585
US11420970, Example 198
CID 156073186
Cyclopentyl-{4-[2-(4-fluoro-phenyl)-5-(4-methyl-piperazin-1-yl)-imidazo[4,5-b]pyridin-1-yl]-pyrimidin-2-yl}-amine
CID 9826083
2-Phenyl-3-[2-((S)-1-phenyl-ethylamino)-pyrimidin-4-yl]-imidazo[1,2-a]pyrimidin-7-ylamine
CID 9953203
{4-[(S)-2-(4-Fluoro-phenyl)-5-(4-methyl-piperazin-1-yl)-imidazo[4,5-b]pyridin-1-yl]-pyrimidin-2-yl}-(1-phenyl-ethyl)-amine
CID 9957918
{4-[7-Dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}pyridin-2-ylamine
CID 24745530
Cyclopropyl{4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}amine
CID 24746216
8-(4-methylcyclohexyl)-N-(5-piperazin-1-yl-2-pyridinyl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58299617
8-(4,4-dimethylcyclohexyl)-N-(5-piperazin-1-yl-2-pyridinyl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 58299870
3-(cyclopropylmethyl)-N-(5-imidazo[1,2-a]pyrimidin-3-yl-2-pyridinyl)-7-methylimidazo[4,5-b]pyridin-5-amine
CID 122688198
3-[2-(Cyclopentylamino)pyrimidin-4-yl]-N-cyclopropyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-amine
CID 10180985
2-Phenyl-3-[2-((S)-1-phenyl-ethylamino)-pyridin-4-yl]-imidazo[1,2-a]pyrimidin-7-ylamine
CID 44344386

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (CID 145424740) is 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is Cc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C)C5(CC5)C4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCN(C5CC5)CC4)n3c2C)N1.Cc1cccnc1C1CCCC(c2nc3cccc(N4CCNC5(CC5)C4)n3c2C)N1.
What is the InChIKey of 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The InChIKey is JCYIDTYYBTZYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H34N6.C25H32N6/c1-18-7-6-14-27-24(18)20-8-4-9-21(28-20)25-19(2)32-22(29-25)10-5-11-23(32)31-16-15-30(3)26(17-31)12-13-26;1-18-6-5-13-27-25(18)21-7-3-8-22(28-21)26-19(2)32-23(29-26)9-4-10-24(32)31-16-14-30(15-17-31)20-11-12-20;1-17-6-5-13-26-23(17)19-7-3-8-20(28-19)24-18(2)31-21(29-24)9-4-10-22(31)30-15-14-27-25(16-30)11-12-25/h5-7,10-11,14,20-21,28H,4,8-9,12-13,15-17H2,1-3H3;4-6,9-10,13,20-22,28H,3,7-8,11-12,14-17H2,1-2H3;4-6,9-10,13,19-20,27-28H,3,7-8,11-12,14-16H2,1-2H3.
What are the key properties of 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine has a molecular weight of 1277.77 g/mol, XLogP of 12.22, 10 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyclopropylpiperazin-1-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4,7-diazaspiro[2.5]octan-7-yl)-3-methyl-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;3-methyl-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 145424740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).