2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide

C20H24N6O — CID 122318233

IUPAC2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cc(N2CCCCC2)nc(CNC(=O)c2c(C)nc3ccccn23)n1
InChIInChI=1S/C20H24N6O/c1-14-12-18(25-9-5-3-6-10-25)24-16(22-14)13-21-20(27)19-15(2)23-17-8-4-7-11-26(17)19/h4,7-8,11-12H,3,5-6,9-10,13H2,1-2H3,(H,21,27)
InChIKeyQERLOCYBRVBNKL-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.66
Rot. Bonds4

About 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 122318233) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID122318233
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cc(N2CCCCC2)nc(CNC(=O)c2c(C)nc3ccccn23)n1
InChIInChI=1S/C20H24N6O/c1-14-12-18(25-9-5-3-6-10-25)24-16(22-14)13-21-20(27)19-15(2)23-17-8-4-7-11-26(17)19/h4,7-8,11-12H,3,5-6,9-10,13H2,1-2H3,(H,21,27)
InChIKeyQERLOCYBRVBNKL-UHFFFAOYSA-N
XLogP2.66
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 122318233) is 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1cc(N2CCCCC2)nc(CNC(=O)c2c(C)nc3ccccn23)n1.
What is the InChIKey of 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is QERLOCYBRVBNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14-12-18(25-9-5-3-6-10-25)24-16(22-14)13-21-20(27)19-15(2)23-17-8-4-7-11-26(17)19/h4,7-8,11-12H,3,5-6,9-10,13H2,1-2H3,(H,21,27).
What are the key properties of 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 122318233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).