8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid

C17H14F2N2O3 — CID 86717884

About 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid

8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 86717884) has the molecular formula C17H14F2N2O3 and a molecular weight of 332.31 g/mol. Its IUPAC name is 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

• Compound Name: 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid
• PubChem CID: 86717884
• Molecular Formula: C17H14F2N2O3
• Molecular Weight: 332.31 g/mol
• Exact Mass: 332.10
• IUPAC Name: 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid
• SMILES: Cc1cc(OCc2c(F)cccc2F)c2nc(C)c(C(=O)O)n2c1
• InChI: InChI=1S/C17H14F2N2O3/c1-9-6-14(24-8-11-12(18)4-3-5-13(11)19)16-20-10(2)15(17(22)23)21(16)7-9/h3-7H,8H2,1-2H3,(H,22,23)
• InChIKey: ZMCVYYVBYXBXAU-UHFFFAOYSA-N
• XLogP: 3.51
• TPSA: 63.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	332.31
LogP ≤ 5	3.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid?

The IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid (CID 86717884) is 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid.

What is the SMILES notation for 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid?

The canonical SMILES for 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid is Cc1cc(OCc2c(F)cccc2F)c2nc(C)c(C(=O)O)n2c1.

What is the InChIKey of 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid?

The InChIKey is ZMCVYYVBYXBXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N2O3/c1-9-6-14(24-8-11-12(18)4-3-5-13(11)19)16-20-10(2)15(17(22)23)21(16)7-9/h3-7H,8H2,1-2H3,(H,22,23).

What are the key properties of 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid?

8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 332.31 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 86717884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).