About 2-(5-methylthiophen-2-yl)quinoxaline
2-(5-methylthiophen-2-yl)quinoxaline (PubChem CID 10680762) has the molecular formula C13H10N2S
and a molecular weight of 226.30 g/mol. Its IUPAC name is 2-(5-methylthiophen-2-yl)quinoxaline.
Molecular Properties
| Compound Name | 2-(5-methylthiophen-2-yl)quinoxaline |
| PubChem CID | 10680762 |
| Molecular Formula | C13H10N2S |
| Molecular Weight | 226.30 g/mol |
| Exact Mass | 226.06 |
| IUPAC Name | 2-(5-methylthiophen-2-yl)quinoxaline |
| SMILES | Cc1ccc(-c2cnc3ccccc3n2)s1 |
| InChI | InChI=1S/C13H10N2S/c1-9-6-7-13(16-9)12-8-14-10-4-2-3-5-11(10)15-12/h2-8H,1H3 |
| InChIKey | YZFFGZARJYJAMF-UHFFFAOYSA-N |
| XLogP | 3.67 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.30 |
| LogP ≤ 5 | 3.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-methylthiophen-2-yl)quinoxaline?
The IUPAC name of 2-(5-methylthiophen-2-yl)quinoxaline (CID 10680762) is 2-(5-methylthiophen-2-yl)quinoxaline.
What is the SMILES notation for 2-(5-methylthiophen-2-yl)quinoxaline?
The canonical SMILES for 2-(5-methylthiophen-2-yl)quinoxaline is Cc1ccc(-c2cnc3ccccc3n2)s1.
What is the InChIKey of 2-(5-methylthiophen-2-yl)quinoxaline?
The InChIKey is YZFFGZARJYJAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2S/c1-9-6-7-13(16-9)12-8-14-10-4-2-3-5-11(10)15-12/h2-8H,1H3.
What are the key properties of 2-(5-methylthiophen-2-yl)quinoxaline?
2-(5-methylthiophen-2-yl)quinoxaline has a molecular weight of 226.30 g/mol, XLogP of 3.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-2-yl)quinoxaline is sourced from PubChem (CID 10680762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).