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

C21H23N5O3 — CID 144545154

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

N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 144545154) has the molecular formula C21H23N5O3 and a molecular weight of 393.45 g/mol. Its IUPAC name is N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 144545154
• Molecular Formula: C21H23N5O3
• Molecular Weight: 393.45 g/mol
• Exact Mass: 393.18
• IUPAC Name: N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
• SMILES: CCOCCC1=NC(c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)NO1
• InChI: InChI=1S/C21H23N5O3/c1-3-28-11-9-19-24-20(25-29-19)15-8-7-14(2)16(12-15)23-21(27)17-13-22-18-6-4-5-10-26(17)18/h4-8,10,12-13,20,25H,3,9,11H2,1-2H3,(H,23,27)
• InChIKey: CTWRNAZVVKGRNE-UHFFFAOYSA-N
• XLogP: 3.25
• TPSA: 89.25 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	393.45
LogP ≤ 5	3.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 144545154) is N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

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

The canonical SMILES for N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is CCOCCC1=NC(c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)NO1.

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

The InChIKey is CTWRNAZVVKGRNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O3/c1-3-28-11-9-19-24-20(25-29-19)15-8-7-14(2)16(12-15)23-21(27)17-13-22-18-6-4-5-10-26(17)18/h4-8,10,12-13,20,25H,3,9,11H2,1-2H3,(H,23,27).

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

N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 393.45 g/mol, XLogP of 3.25, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[5-(2-ethoxyethyl)-2,3-dihydro-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 144545154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).