5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide

C26H27N5O3 — CID 42164931

About 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide

5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide (PubChem CID 42164931) has the molecular formula C26H27N5O3 and a molecular weight of 457.53 g/mol. Its IUPAC name is 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide.

Molecular Properties

• Compound Name: 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide
• PubChem CID: 42164931
• Molecular Formula: C26H27N5O3
• Molecular Weight: 457.53 g/mol
• Exact Mass: 457.21
• IUPAC Name: 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide
• SMILES: CNC(=O)c1cn(CCCc2ccccc2)cc(C(=O)NCc2cn3cc(C)ccc3n2)c1=O
• InChI: InChI=1S/C26H27N5O3/c1-18-10-11-23-29-20(15-31(23)14-18)13-28-26(34)22-17-30(16-21(24(22)32)25(33)27-2)12-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-11,14-17H,6,9,12-13H2,1-2H3,(H,27,33)(H,28,34)
• InChIKey: GUMXAOCFVFGSHJ-UHFFFAOYSA-N
• XLogP: 2.73
• TPSA: 97.50 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	457.53
LogP ≤ 5	2.73
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide?

The IUPAC name of 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide (CID 42164931) is 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide.

What is the SMILES notation for 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide?

The canonical SMILES for 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide is CNC(=O)c1cn(CCCc2ccccc2)cc(C(=O)NCc2cn3cc(C)ccc3n2)c1=O.

What is the InChIKey of 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide?

The InChIKey is GUMXAOCFVFGSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N5O3/c1-18-10-11-23-29-20(15-31(23)14-18)13-28-26(34)22-17-30(16-21(24(22)32)25(33)27-2)12-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-11,14-17H,6,9,12-13H2,1-2H3,(H,27,33)(H,28,34).

What are the key properties of 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide?

5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide has a molecular weight of 457.53 g/mol, XLogP of 2.73, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-N-methyl-3-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxo-1-(3-phenylpropyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 42164931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).