Basic information
- Standard SMILES
CCOC(=O)C1CCCN(C(=O)CCc2cccs2)C1- InChIKey
MUDVMXOBDOEZDN-UHFFFAOYSA-N- Molecular formula
- C15H21NO3S
- Average molar mass
- 295.4 g/mol
- Monoisotopic mass
- 295.12421471
Names & identifiers
- Preferred name
- Ethyl 1-(3-(2-thienyl)propionyl)-3-piperidinecarboxylate
- IUPAC
- ethyl 1-(3-thiophen-2-ylpropanoyl)piperidine-3-carboxylate
Names & synonyms
SCHEMBL7233937MUDVMXOBDOEZDN-UHFFFAOYSA-NAKOS008955647ethyl 1-(3-(2-thienyl)propionyl)-3-piperidinecarboxylate
Database identifiers
- PubChem CID
- 18760281
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
2 records
Compound notes
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