About 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide
4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide (PubChem CID 43616210) has the molecular formula C11H12N4O2S
and a molecular weight of 264.31 g/mol. Its IUPAC name is 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide.
Molecular Properties
| Compound Name | 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide |
| PubChem CID | 43616210 |
| Molecular Formula | C11H12N4O2S |
| Molecular Weight | 264.31 g/mol |
| Exact Mass | 264.07 |
| IUPAC Name | 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide |
| SMILES | CNc1ccc(S(=O)(=O)Nc2cnccn2)cc1 |
| InChI | InChI=1S/C11H12N4O2S/c1-12-9-2-4-10(5-3-9)18(16,17)15-11-8-13-6-7-14-11/h2-8,12H,1H3,(H,14,15) |
| InChIKey | GNAJXRSXBSBIKF-UHFFFAOYSA-N |
| XLogP | 1.32 |
| TPSA | 83.98 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 264.31 |
| LogP ≤ 5 | 1.32 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The IUPAC name of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide (CID 43616210) is 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The canonical SMILES for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide is CNc1ccc(S(=O)(=O)Nc2cnccn2)cc1.
What is the InChIKey of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
The InChIKey is GNAJXRSXBSBIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-12-9-2-4-10(5-3-9)18(16,17)15-11-8-13-6-7-14-11/h2-8,12H,1H3,(H,14,15).
What are the key properties of 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide?
4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide has a molecular weight of 264.31 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-pyrazin-2-ylbenzenesulfonamide is sourced from PubChem (CID 43616210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).