About 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine
2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine (PubChem CID 14652) has the molecular formula C14H12N2O2S
and a molecular weight of 272.33 g/mol. Its IUPAC name is 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine.
Molecular Properties
| Compound Name | 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine |
| PubChem CID | 14652 |
| Molecular Formula | C14H12N2O2S |
| Molecular Weight | 272.33 g/mol |
| Exact Mass | 272.06 |
| IUPAC Name | 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine |
| SMILES | CS(=O)(=O)c1ccc(-c2cn3ccccc3n2)cc1 |
| InChI | InChI=1S/C14H12N2O2S/c1-19(17,18)12-7-5-11(6-8-12)13-10-16-9-3-2-4-14(16)15-13/h2-10H,1H3 |
| InChIKey | VSLIUWLPFRVCDL-UHFFFAOYSA-N |
| XLogP | 2.40 |
| TPSA | 51.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 272.33 |
| LogP ≤ 5 | 2.40 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine (CID 14652) is 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine is CS(=O)(=O)c1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine?
The InChIKey is VSLIUWLPFRVCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2S/c1-19(17,18)12-7-5-11(6-8-12)13-10-16-9-3-2-4-14(16)15-13/h2-10H,1H3.
What are the key properties of 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine?
2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine has a molecular weight of 272.33 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 14652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).