N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide

C24H26N6O3 — CID 71282350

About N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide

N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71282350) has the molecular formula C24H26N6O3 and a molecular weight of 446.51 g/mol. Its IUPAC name is N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 71282350
• Molecular Formula: C24H26N6O3
• Molecular Weight: 446.51 g/mol
• Exact Mass: 446.21
• IUPAC Name: N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
• SMILES: CCN(CC)C(=O)CCc1nc(-c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)no1
• InChI: InChI=1S/C24H26N6O3/c1-4-29(5-2)22(31)12-11-21-27-23(28-33-21)17-10-9-16(3)18(14-17)26-24(32)19-15-25-20-8-6-7-13-30(19)20/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,26,32)
• InChIKey: UUXHARTWQYUXCU-UHFFFAOYSA-N
• XLogP: 3.75
• TPSA: 105.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 8
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	446.51
LogP ≤ 5	3.75
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 71282350) is N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is CCN(CC)C(=O)CCc1nc(-c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)no1.

What is the InChIKey of N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is UUXHARTWQYUXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O3/c1-4-29(5-2)22(31)12-11-21-27-23(28-33-21)17-10-9-16(3)18(14-17)26-24(32)19-15-25-20-8-6-7-13-30(19)20/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,26,32).

What are the key properties of N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?

N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 446.51 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71282350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).