1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine

C92H102N22O2 — CID 157348306

IUPAC1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine
SMILESCc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)C(=O)C4)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)CC4=O)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2ccccn2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2cccnc2)N1
InChIInChI=1S/2C23H28N6O.2C23H23N5/c1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)22(30)15-28;1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)15-22(28)30;1-16-8-7-14-25-21(16)17-10-6-11-18(26-17)22-23(19-9-2-4-13-24-19)28-15-5-3-12-20(28)27-22;1-16-7-5-13-25-21(16)18-9-4-10-19(26-18)22-23(17-8-6-12-24-15-17)28-14-3-2-11-20(28)27-22/h2*4-6,9-11,14,17-18,25H,3,7-8,12-13,15H2,1-2H3;2-5,7-9,12-15,17-18,26H,6,10-11H2,1H3;2-3,5-8,11-15,18-19,26H,4,9-10H2,1H3/t3*17-,18+;18-,19+/m1100/s1
InChIKeyBHFRVORMMSEOKU-XKMWOLGQSA-N
MW1547.98 g/mol
LogP15.06
Rot. Bonds12

About 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine

1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine (PubChem CID 157348306) has the molecular formula C92H102N22O2 and a molecular weight of 1547.98 g/mol. Its IUPAC name is 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine
PubChem CID157348306
Molecular FormulaC92H102N22O2
Molecular Weight1547.98 g/mol
Exact Mass1546.86
IUPAC Name1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine
SMILESCc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)C(=O)C4)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)CC4=O)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2ccccn2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2cccnc2)N1
InChIInChI=1S/2C23H28N6O.2C23H23N5/c1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)22(30)15-28;1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)15-22(28)30;1-16-8-7-14-25-21(16)17-10-6-11-18(26-17)22-23(19-9-2-4-13-24-19)28-15-5-3-12-20(28)27-22;1-16-7-5-13-25-21(16)18-9-4-10-19(26-18)22-23(17-8-6-12-24-15-17)28-14-3-2-11-20(28)27-22/h2*4-6,9-11,14,17-18,25H,3,7-8,12-13,15H2,1-2H3;2-5,7-9,12-15,17-18,26H,6,10-11H2,1H3;2-3,5-8,11-15,18-19,26H,4,9-10H2,1H3/t3*17-,18+;18-,19+/m1100/s1
InChIKeyBHFRVORMMSEOKU-XKMWOLGQSA-N
XLogP15.06
TPSA241.76 Ų
H-Bond Donors4
H-Bond Acceptors22
Rotatable Bonds12
Heavy Atoms116
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001547.98
LogP ≤ 515.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1022

Analyze 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine?
The IUPAC name of 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine (CID 157348306) is 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine is Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)C(=O)C4)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(N4CCN(C)CC4=O)cccc3n2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2ccccn2)N1.Cc1cccnc1[C@@H]1CCC[C@H](c2nc3ccccn3c2-c2cccnc2)N1.
What is the InChIKey of 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine?
The InChIKey is BHFRVORMMSEOKU-XKMWOLGQSA-N. The full InChI is InChI=1S/2C23H28N6O.2C23H23N5/c1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)22(30)15-28;1-16-6-5-11-24-23(16)18-8-3-7-17(25-18)19-14-29-20(26-19)9-4-10-21(29)28-13-12-27(2)15-22(28)30;1-16-8-7-14-25-21(16)17-10-6-11-18(26-17)22-23(19-9-2-4-13-24-19)28-15-5-3-12-20(28)27-22;1-16-7-5-13-25-21(16)18-9-4-10-19(26-18)22-23(17-8-6-12-24-15-17)28-14-3-2-11-20(28)27-22/h2*4-6,9-11,14,17-18,25H,3,7-8,12-13,15H2,1-2H3;2-5,7-9,12-15,17-18,26H,6,10-11H2,1H3;2-3,5-8,11-15,18-19,26H,4,9-10H2,1H3/t3*17-,18+;18-,19+/m1100/s1.
What are the key properties of 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine?
1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine has a molecular weight of 1547.98 g/mol, XLogP of 15.06, 12 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;4-methyl-1-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperazin-2-one;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-2-ylimidazo[1,2-a]pyridine;2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridin-3-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 157348306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).