Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCCCC1CC(=O)OCC(=O)c1ccc(F)cc1- InChIKey
AKLKEXVAGGQDKK-UHFFFAOYSA-N- Molecular formula
- C20H26FNO5
- Average molar mass
- 379.4 g/mol
Names & identifiers
- Preferred name
- (RS)-2-[2-(4-Fluoro-phenyl)-2-oxo-ethoxycarbonylmethyl]-piperidine-1-carboxylic tert butyl ester
- IUPAC
- tert-butyl 2-[2-[2-(4-fluorophenyl)-2-oxoethoxy]-2-oxoethyl]piperidine-1-carboxylate
Names & synonyms
AKLKEXVAGGQDKK-UHFFFAOYSA-N(RS)-2-[2-(4-Fluoro-phenyl)-2-oxo-ethoxycarbonylmethyl]-piperidine-1-carboxylic tert butyl ester
Database identifiers
- PubChem CID
- 86629009
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 537
Related reactions
3 records
Compound notes
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