Basic information
- Standard SMILES
COC(=O)c1c(S(=O)(=O)NC(C)(C)C)ccn1C- InChIKey
FYILIIREVPFQBS-UHFFFAOYSA-N- Molecular formula
- C11H18N2O4S
- Average molar mass
- 274.34 g/mol
- Monoisotopic mass
- 274.09872823
Names & identifiers
- Preferred name
- Methyl 3-[[(1,1-dimethylethyl)amino]sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate
- IUPAC
- methyl 3-(tert-butylsulfamoyl)-1-methylpyrrole-2-carboxylate
Names & synonyms
SCHEMBL9021915FYILIIREVPFQBS-UHFFFAOYSA-Nmethyl 3-[[(1,1-dimethylethyl)amino]-sulfonyl]-1-methyl-1H-pyrrole-2-carboxylateMethyl 3-[[(1,1-dimethylethyl)amino]sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate
Database identifiers
- PubChem CID
- 19693837
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 408
Related reactions
13 records
Linked notes
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