3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide

C26H21ClF3N3O — CID 83289107

About 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide

3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide (PubChem CID 83289107) has the molecular formula C26H21ClF3N3O and a molecular weight of 483.92 g/mol. Its IUPAC name is 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide.

Molecular Properties

• Compound Name: 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide
• PubChem CID: 83289107
• Molecular Formula: C26H21ClF3N3O
• Molecular Weight: 483.92 g/mol
• Exact Mass: 483.13
• IUPAC Name: 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide
• SMILES: O=C(CCc1c(-c2ccc(Cl)cc2)nc2ccc(-c3cccc(C(F)(F)F)c3)cn12)NC1CC1
• InChI: InChI=1S/C26H21ClF3N3O/c27-20-7-4-16(5-8-20)25-22(11-13-24(34)31-21-9-10-21)33-15-18(6-12-23(33)32-25)17-2-1-3-19(14-17)26(28,29)30/h1-8,12,14-15,21H,9-11,13H2,(H,31,34)
• InChIKey: HVQUTMOYAOMEIJ-UHFFFAOYSA-N
• XLogP: 6.55
• TPSA: 46.40 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 6
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	483.92
LogP ≤ 5	6.55
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

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

The IUPAC name of 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide (CID 83289107) is 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide.

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

The canonical SMILES for 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide is O=C(CCc1c(-c2ccc(Cl)cc2)nc2ccc(-c3cccc(C(F)(F)F)c3)cn12)NC1CC1.

What is the InChIKey of 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide?

The InChIKey is HVQUTMOYAOMEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21ClF3N3O/c27-20-7-4-16(5-8-20)25-22(11-13-24(34)31-21-9-10-21)33-15-18(6-12-23(33)32-25)17-2-1-3-19(14-17)26(28,29)30/h1-8,12,14-15,21H,9-11,13H2,(H,31,34).

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

3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide has a molecular weight of 483.92 g/mol, XLogP of 6.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide is sourced from PubChem (CID 83289107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).