About 1-thiophen-2-ylsulfonylpiperazine
1-thiophen-2-ylsulfonylpiperazine (PubChem CID 3865892) has the molecular formula C8H12N2O2S2
and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-thiophen-2-ylsulfonylpiperazine.
Molecular Properties
| Compound Name | 1-thiophen-2-ylsulfonylpiperazine |
| PubChem CID | 3865892 |
| Molecular Formula | C8H12N2O2S2 |
| Molecular Weight | 232.33 g/mol |
| Exact Mass | 232.03 |
| IUPAC Name | 1-thiophen-2-ylsulfonylpiperazine |
| SMILES | O=S(=O)(c1cccs1)N1CCNCC1 |
| InChI | InChI=1S/C8H12N2O2S2/c11-14(12,8-2-1-7-13-8)10-5-3-9-4-6-10/h1-2,7,9H,3-6H2 |
| InChIKey | JEVLAMZYGHEJIS-UHFFFAOYSA-N |
| XLogP | 0.34 |
| TPSA | 49.41 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.33 |
| LogP ≤ 5 | 0.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-thiophen-2-ylsulfonylpiperazine?
The IUPAC name of 1-thiophen-2-ylsulfonylpiperazine (CID 3865892) is 1-thiophen-2-ylsulfonylpiperazine.
What is the SMILES notation for 1-thiophen-2-ylsulfonylpiperazine?
The canonical SMILES for 1-thiophen-2-ylsulfonylpiperazine is O=S(=O)(c1cccs1)N1CCNCC1.
What is the InChIKey of 1-thiophen-2-ylsulfonylpiperazine?
The InChIKey is JEVLAMZYGHEJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S2/c11-14(12,8-2-1-7-13-8)10-5-3-9-4-6-10/h1-2,7,9H,3-6H2.
What are the key properties of 1-thiophen-2-ylsulfonylpiperazine?
1-thiophen-2-ylsulfonylpiperazine has a molecular weight of 232.33 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-2-ylsulfonylpiperazine is sourced from PubChem (CID 3865892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).