6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine

C12H15FN2O3S — CID 170434790

IUPAC6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine
SMILESCOc1cc2nccn2cc1S(=O)(=O)C(C)(C)CF
InChIInChI=1S/C12H15FN2O3S/c1-12(2,8-13)19(16,17)10-7-15-5-4-14-11(15)6-9(10)18-3/h4-7H,8H2,1-3H3
InChIKeyAITHHPSDPVMLOI-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.86
Rot. Bonds4

About 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine

6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine (PubChem CID 170434790) has the molecular formula C12H15FN2O3S and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine
PubChem CID170434790
Molecular FormulaC12H15FN2O3S
Molecular Weight286.33 g/mol
Exact Mass286.08
IUPAC Name6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine
SMILESCOc1cc2nccn2cc1S(=O)(=O)C(C)(C)CF
InChIInChI=1S/C12H15FN2O3S/c1-12(2,8-13)19(16,17)10-7-15-5-4-14-11(15)6-9(10)18-3/h4-7H,8H2,1-3H3
InChIKeyAITHHPSDPVMLOI-UHFFFAOYSA-N
XLogP1.86
TPSA60.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine?
The IUPAC name of 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine (CID 170434790) is 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine is COc1cc2nccn2cc1S(=O)(=O)C(C)(C)CF.
What is the InChIKey of 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine?
The InChIKey is AITHHPSDPVMLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O3S/c1-12(2,8-13)19(16,17)10-7-15-5-4-14-11(15)6-9(10)18-3/h4-7H,8H2,1-3H3.
What are the key properties of 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine?
6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine has a molecular weight of 286.33 g/mol, XLogP of 1.86, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-fluoro-2-methylpropan-2-yl)sulfonyl-7-methoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 170434790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).