8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane

C20H22N4O2S — CID 144870470

About 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane

8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane (PubChem CID 144870470) has the molecular formula C20H22N4O2S and a molecular weight of 382.49 g/mol. Its IUPAC name is 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane.

Molecular Properties

• Compound Name: 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane
• PubChem CID: 144870470
• Molecular Formula: C20H22N4O2S
• Molecular Weight: 382.49 g/mol
• Exact Mass: 382.15
• IUPAC Name: 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane
• SMILES: CC.Cc1ccc(-c2cnc3c(-n4c(C)cnc4C)cc(C(=O)O)cn23)s1
• InChI: InChI=1S/C18H16N4O2S.C2H6/c1-10-7-19-12(3)22(10)14-6-13(18(23)24)9-21-15(8-20-17(14)21)16-5-4-11(2)25-16;1-2/h4-9H,1-3H3,(H,23,24);1-2H3
• InChIKey: UHDGPORBFMBWFL-UHFFFAOYSA-N
• XLogP: 4.90
• TPSA: 72.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	382.49
LogP ≤ 5	4.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane?

The IUPAC name of 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane (CID 144870470) is 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane.

What is the SMILES notation for 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane?

The canonical SMILES for 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane is CC.Cc1ccc(-c2cnc3c(-n4c(C)cnc4C)cc(C(=O)O)cn23)s1.

What is the InChIKey of 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane?

The InChIKey is UHDGPORBFMBWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2S.C2H6/c1-10-7-19-12(3)22(10)14-6-13(18(23)24)9-21-15(8-20-17(14)21)16-5-4-11(2)25-16;1-2/h4-9H,1-3H3,(H,23,24);1-2H3.

What are the key properties of 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane?

8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane has a molecular weight of 382.49 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(2,5-dimethylimidazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid;ethane is sourced from PubChem (CID 144870470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).