3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide

C27H28ClN3O2 — CID 83282480

About 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide

3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide (PubChem CID 83282480) has the molecular formula C27H28ClN3O2 and a molecular weight of 461.99 g/mol. Its IUPAC name is 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide.

Molecular Properties

• Compound Name: 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide
• PubChem CID: 83282480
• Molecular Formula: C27H28ClN3O2
• Molecular Weight: 461.99 g/mol
• Exact Mass: 461.19
• IUPAC Name: 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide
• SMILES: CCOc1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(CCC(=O)NC(C)C)n3c2)c1
• InChI: InChI=1S/C27H28ClN3O2/c1-4-33-23-7-5-6-20(16-23)21-10-14-25-30-27(19-8-11-22(28)12-9-19)24(31(25)17-21)13-15-26(32)29-18(2)3/h5-12,14,16-18H,4,13,15H2,1-3H3,(H,29,32)
• InChIKey: CGJMNIDMSQZPPG-UHFFFAOYSA-N
• XLogP: 6.18
• TPSA: 55.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	461.99
LogP ≤ 5	6.18
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide?

The IUPAC name of 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide (CID 83282480) is 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide.

What is the SMILES notation for 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide?

The canonical SMILES for 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide is CCOc1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(CCC(=O)NC(C)C)n3c2)c1.

What is the InChIKey of 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide?

The InChIKey is CGJMNIDMSQZPPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28ClN3O2/c1-4-33-23-7-5-6-20(16-23)21-10-14-25-30-27(19-8-11-22(28)12-9-19)24(31(25)17-21)13-15-26(32)29-18(2)3/h5-12,14,16-18H,4,13,15H2,1-3H3,(H,29,32).

What are the key properties of 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide?

3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide has a molecular weight of 461.99 g/mol, XLogP of 6.18, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(4-chlorophenyl)-6-(3-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-N-propan-2-ylpropanamide is sourced from PubChem (CID 83282480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).