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

C₂₀H₂₅N₅O — CID 156621895

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

[5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 156621895) has the molecular formula C₂₀H₂₅N₅O and a molecular weight of 351.45 g/mol. Its IUPAC name is [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

• Compound Name: [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol
• PubChem CID: 156621895
• Molecular Formula: C₂₀H₂₅N₅O
• Molecular Weight: 351.45 g/mol
• Exact Mass: 351.21
• IUPAC Name: [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol
• SMILES: Cc1cccnc1[C@H]1CCC[C@@H](c2nc3cccc(N)n3c2CO)N1C
• InChI: InChI=1S/C20H25N5O/c1-13-6-5-11-22-19(13)14-7-3-8-15(24(14)2)20-16(12-26)25-17(21)9-4-10-18(25)23-20/h4-6,9-11,14-15,26H,3,7-8,12,21H2,1-2H3/t14-,15+/m1/s1
• InChIKey: ZGNSIJHHOGWDBT-CABCVRRESA-N
• XLogP: 3.01
• TPSA: 79.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	351.45
LogP ≤ 5	3.01
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol?

The IUPAC name of [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol (CID 156621895) is [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol.

What is the SMILES notation for [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol?

The canonical SMILES for [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol is Cc1cccnc1[C@H]1CCC[C@@H](c2nc3cccc(N)n3c2CO)N1C.

What is the InChIKey of [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol?

The InChIKey is ZGNSIJHHOGWDBT-CABCVRRESA-N. The full InChI is InChI=1S/C20H25N5O/c1-13-6-5-11-22-19(13)14-7-3-8-15(24(14)2)20-16(12-26)25-17(21)9-4-10-18(25)23-20/h4-6,9-11,14-15,26H,3,7-8,12,21H2,1-2H3/t14-,15+/m1/s1.

What are the key properties of [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol?

[5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 351.45 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for [5-amino-2-[(2S,6R)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 156621895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 156621895 — identifiers, structure, computed properties (public domain)

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