N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C26H26N4O3 — CID 55581211

About N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 55581211) has the molecular formula C26H26N4O3 and a molecular weight of 442.52 g/mol. Its IUPAC name is N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

• Compound Name: N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
• PubChem CID: 55581211
• Molecular Formula: C26H26N4O3
• Molecular Weight: 442.52 g/mol
• Exact Mass: 442.20
• IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
• SMILES: CC(=O)Nc1cccc(C(C)NC(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)c1
• InChI: InChI=1S/C26H26N4O3/c1-17-10-11-25-29-23(15-30(25)14-17)16-33-24-9-5-7-21(13-24)26(32)27-18(2)20-6-4-8-22(12-20)28-19(3)31/h4-15,18H,16H2,1-3H3,(H,27,32)(H,28,31)
• InChIKey: SNCGVPHFGASTEK-UHFFFAOYSA-N
• XLogP: 4.67
• TPSA: 84.73 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	442.52
LogP ≤ 5	4.67
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The IUPAC name of N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 55581211) is N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

What is the SMILES notation for N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The canonical SMILES for N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is CC(=O)Nc1cccc(C(C)NC(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)c1.

What is the InChIKey of N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The InChIKey is SNCGVPHFGASTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O3/c1-17-10-11-25-29-23(15-30(25)14-17)16-33-24-9-5-7-21(13-24)26(32)27-18(2)20-6-4-8-22(12-20)28-19(3)31/h4-15,18H,16H2,1-3H3,(H,27,32)(H,28,31).

What are the key properties of N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 442.52 g/mol, XLogP of 4.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(3-acetamidophenyl)ethyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 55581211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).