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

C24H29N5O — CID 146555566

IUPAC1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one
SMILESCc1cccnc1[C@@H]1CCC[C@H](c2cn3c(C4CCC(=O)N(C)C4)cccc3n2)N1
InChIInChI=1S/C24H29N5O/c1-16-6-5-13-25-24(16)19-8-3-7-18(26-19)20-15-29-21(9-4-10-22(29)27-20)17-11-12-23(30)28(2)14-17/h4-6,9-10,13,15,17-19,26H,3,7-8,11-12,14H2,1-2H3/t17?,18-,19+/m1/s1
InChIKeyAEISCQHJJUCOCX-CPSIJMPNSA-N
MW403.53 g/mol
LogP3.93
Rot. Bonds3

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

1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one (PubChem CID 146555566) has the molecular formula C24H29N5O and a molecular weight of 403.53 g/mol. Its IUPAC name is 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one.

Molecular Properties

Compound Name1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one
PubChem CID146555566
Molecular FormulaC24H29N5O
Molecular Weight403.53 g/mol
Exact Mass403.24
IUPAC Name1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one
SMILESCc1cccnc1[C@@H]1CCC[C@H](c2cn3c(C4CCC(=O)N(C)C4)cccc3n2)N1
InChIInChI=1S/C24H29N5O/c1-16-6-5-13-25-24(16)19-8-3-7-18(26-19)20-15-29-21(9-4-10-22(29)27-20)17-11-12-23(30)28(2)14-17/h4-6,9-10,13,15,17-19,26H,3,7-8,11-12,14H2,1-2H3/t17?,18-,19+/m1/s1
InChIKeyAEISCQHJJUCOCX-CPSIJMPNSA-N
XLogP3.93
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-[(2R,6S)-6-[5-[2-[(2R,4R,6S)-6-(3-chloro-2-pyridinyl)-4-methoxypiperidin-2-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-8-yl]-3-methyl-2-pyridinyl]piperidin-2-yl]-7-[5-methyl-6-[(2S,6R)-6-[5-(1-methyl-2-oxopiperidin-4-yl)imidazo[1,2-a]pyridin-2-yl]piperidin-2-yl]-3-pyridinyl]imidazo[1,2-a]pyridin-5-yl]-1-methylpiperidin-2-one
CID 145424767
2-[(2S,6R)-6-(3-chloro-2-pyridinyl)piperidin-2-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine
CID 145424524
1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridinyl]piperazine
CID 163885662
3-chloropyridine;2-[6-(3-chloro-2-pyridinyl)piperidin-2-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine;5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine;5-(4-methylpiperazin-1-yl)-2-[6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;piperidine
CID 145424790
3-chloro-5-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
CID 146555557
2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-pyridin-3-ylimidazo[1,2-a]pyridine
CID 146555533
4-(1-methylpiperidin-4-yl)-2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-1H-benzimidazole
CID 154620200
2-[(5-methyl-3,4-dihydropyridin-6-yl)methyl]-6-[(6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]pyridine
CID 162531886
3-chloro-5-(4-methyl-4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
CID 146555508
5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
CID 155373984
2-[6-(5-methyl-3,4-dihydropyridin-6-yl)piperidin-2-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine
CID 145424664
5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine;5-(4-methyl-4,7-diazaspiro[2.5]octan-7-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]-3-piperazin-1-ylimidazo[1,2-a]pyridine;3-(4-methylpiperazin-1-yl)-2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
CID 157140110

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one?
The IUPAC name of 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one (CID 146555566) is 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one.
What is the SMILES notation for 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one?
The canonical SMILES for 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one is Cc1cccnc1[C@@H]1CCC[C@H](c2cn3c(C4CCC(=O)N(C)C4)cccc3n2)N1.
What is the InChIKey of 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one?
The InChIKey is AEISCQHJJUCOCX-CPSIJMPNSA-N. The full InChI is InChI=1S/C24H29N5O/c1-16-6-5-13-25-24(16)19-8-3-7-18(26-19)20-15-29-21(9-4-10-22(29)27-20)17-11-12-23(30)28(2)14-17/h4-6,9-10,13,15,17-19,26H,3,7-8,11-12,14H2,1-2H3/t17?,18-,19+/m1/s1.
What are the key properties of 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one?
1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one has a molecular weight of 403.53 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-5-yl]piperidin-2-one is sourced from PubChem (CID 146555566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).