Methyl 3-[[(1,1-dimethylethyl)amino]sulfonyl]-1-methyl-1H-pyrrole-2-carboxylate

HCID 19693837

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

Related reactions

13 records

Linked notes

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