Basic information
- Standard SMILES
CCOC(=O)c1cc(CC)sc1NC(=O)C(C)C- InChIKey
AFQJGIVHAURZIY-UHFFFAOYSA-N- Molecular formula
- C13H19NO3S
- Average molar mass
- 269.36 g/mol
Names & identifiers
- Preferred name
- Ethyl 5-ethyl-2-(2-methylpropanoylamino)thiophene-3-carboxylate
- IUPAC
- ethyl 5-ethyl-2-(2-methylpropanoylamino)thiophene-3-carboxylate
Names & synonyms
SCHEMBL11474809AFQJGIVHAURZIY-UHFFFAOYSA-NHMS1598G17ethyl 5-ethyl-2-(2-methylpropanoylamino)thiophene-3-carboxylateAKOS002258801ST50203107SR-01000284711SR-01000284711-1ethyl 5-ethyl-2-(isobutyrylamino)-3-thiophenecarboxylateN-(3-carbethoxy-5-ethyl-2-thienyl)-2-methylpropanamide
Database identifiers
- PubChem CID
- 734585
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 307
Related reactions
3 records
Compound notes
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