6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide

C24H19F3N4O2S — CID 165143172

About 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide

6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide (PubChem CID 165143172) has the molecular formula C24H19F3N4O2S and a molecular weight of 484.50 g/mol. Its IUPAC name is 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
• PubChem CID: 165143172
• Molecular Formula: C24H19F3N4O2S
• Molecular Weight: 484.50 g/mol
• Exact Mass: 484.12
• IUPAC Name: 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
• SMILES: CC1CN(C(=O)c2cnc3ccccn23)Cc2scc(C(=O)Nc3cccc(C(F)(F)F)c3)c21
• InChI: InChI=1S/C24H19F3N4O2S/c1-14-11-30(23(33)18-10-28-20-7-2-3-8-31(18)20)12-19-21(14)17(13-34-19)22(32)29-16-6-4-5-15(9-16)24(25,26)27/h2-10,13-14H,11-12H2,1H3,(H,29,32)
• InChIKey: MDXWJHRGTWJTJO-UHFFFAOYSA-N
• XLogP: 5.43
• TPSA: 66.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	484.50
LogP ≤ 5	5.43
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide?

The IUPAC name of 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide (CID 165143172) is 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide.

What is the SMILES notation for 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide?

The canonical SMILES for 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide is CC1CN(C(=O)c2cnc3ccccn23)Cc2scc(C(=O)Nc3cccc(C(F)(F)F)c3)c21.

What is the InChIKey of 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide?

The InChIKey is MDXWJHRGTWJTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F3N4O2S/c1-14-11-30(23(33)18-10-28-20-7-2-3-8-31(18)20)12-19-21(14)17(13-34-19)22(32)29-16-6-4-5-15(9-16)24(25,26)27/h2-10,13-14H,11-12H2,1H3,(H,29,32).

What are the key properties of 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide?

6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide has a molecular weight of 484.50 g/mol, XLogP of 5.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(imidazo[1,2-a]pyridine-3-carbonyl)-4-methyl-N-[3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 165143172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).