Basic information
- Standard SMILES
COC(=O)c1ccsc1NCC(C)C- InChIKey
JISNDRUELDGWSG-UHFFFAOYSA-N- Molecular formula
- C10H15NO2S
- Average molar mass
- 213.3 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(isobutylamino)thiophene-3-carboxylate
- IUPAC
- methyl 2-(2-methylpropylamino)thiophene-3-carboxylate
Names & synonyms
SCHEMBL2207556JISNDRUELDGWSG-UHFFFAOYSA-Nmethyl 2-(isobutylamino)thiophene-3-carboxylate
Database identifiers
- PubChem CID
- 67317044
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 197
Related reactions
7 records
Compound notes
Loading…