1-Methyl-1H-pyrazole-4-sulfonic acid methyl-(2-oxo-ethyl)-amide
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CN(CC=O)S(=O)(=O)c1cnn(C)c1- InChIKey
NXLIRVHGFDIKRY-UHFFFAOYSA-N- Molecular formula
- C7H11N3O3S
- Average molar mass
- 217.25 g/mol
- Monoisotopic mass
- 217.05211239
Names & identifiers
- Preferred name
- 1-Methyl-1H-pyrazole-4-sulfonic acid methyl-(2-oxo-ethyl)-amide
- IUPAC
- N,1-dimethyl-N-(2-oxoethyl)pyrazole-4-sulfonamide
Names & synonyms
SCHEMBL2333040NXLIRVHGFDIKRY-UHFFFAOYSA-N1-Methyl-1H-pyrazole-4-sulfonic acid methyl-(2-oxo-ethyl)-amide
Database identifiers
- PubChem CID
- 86640211
Properties
Computed structural propertiesFilling in
- XLogP
- -1.1
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 298
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
4 records
Compound notes
Loading…