N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

C25H24ClN3O2 — CID 171679231

About N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 171679231) has the molecular formula C25H24ClN3O2 and a molecular weight of 433.94 g/mol. Its IUPAC name is N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

• Compound Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
• PubChem CID: 171679231
• Molecular Formula: C25H24ClN3O2
• Molecular Weight: 433.94 g/mol
• Exact Mass: 433.16
• IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
• SMILES: COc1ccc(CNC(=O)Cc2c(-c3ccc(C)cc3)nc3ccc(C)cn23)cc1Cl
• InChI: InChI=1S/C25H24ClN3O2/c1-16-4-8-19(9-5-16)25-21(29-15-17(2)6-11-23(29)28-25)13-24(30)27-14-18-7-10-22(31-3)20(26)12-18/h4-12,15H,13-14H2,1-3H3,(H,27,30)
• InChIKey: PTAQXQYOGZKORT-UHFFFAOYSA-N
• XLogP: 5.14
• TPSA: 55.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	433.94
LogP ≤ 5	5.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?

The IUPAC name of N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (CID 171679231) is N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.

What is the SMILES notation for N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?

The canonical SMILES for N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is COc1ccc(CNC(=O)Cc2c(-c3ccc(C)cc3)nc3ccc(C)cn23)cc1Cl.

What is the InChIKey of N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?

The InChIKey is PTAQXQYOGZKORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClN3O2/c1-16-4-8-19(9-5-16)25-21(29-15-17(2)6-11-23(29)28-25)13-24(30)27-14-18-7-10-22(31-3)20(26)12-18/h4-12,15H,13-14H2,1-3H3,(H,27,30).

What are the key properties of N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?

N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 433.94 g/mol, XLogP of 5.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3-chloro-4-methoxyphenyl)methyl]-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 171679231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).