About N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide
N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide (PubChem CID 51086656) has the molecular formula C10H14N6O2S
and a molecular weight of 282.33 g/mol. Its IUPAC name is N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide.
Molecular Properties
| Compound Name | N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide |
| PubChem CID | 51086656 |
| Molecular Formula | C10H14N6O2S |
| Molecular Weight | 282.33 g/mol |
| Exact Mass | 282.09 |
| IUPAC Name | N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide |
| SMILES | CS(=O)(=O)NCCNc1cncc(-n2cccn2)n1 |
| InChI | InChI=1S/C10H14N6O2S/c1-19(17,18)14-5-4-12-9-7-11-8-10(15-9)16-6-2-3-13-16/h2-3,6-8,14H,4-5H2,1H3,(H,12,15) |
| InChIKey | WZUCVWJQZYFLCP-UHFFFAOYSA-N |
| XLogP | -0.38 |
| TPSA | 101.80 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.33 |
| LogP ≤ 5 | -0.38 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 7 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide (CID 51086656) is N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide is CS(=O)(=O)NCCNc1cncc(-n2cccn2)n1.
What is the InChIKey of N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide?
The InChIKey is WZUCVWJQZYFLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2S/c1-19(17,18)14-5-4-12-9-7-11-8-10(15-9)16-6-2-3-13-16/h2-3,6-8,14H,4-5H2,1H3,(H,12,15).
What are the key properties of N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide?
N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide has a molecular weight of 282.33 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide is sourced from PubChem (CID 51086656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).