1-{2-[4-(Chloro-ethyl)-phenoxy]-ethyl}-piperidine
Basic information
- Standard SMILES
ClCCc1ccc(OCCN2CCCCC2)cc1- InChIKey
ZQGMEPBICQEXCJ-UHFFFAOYSA-N- Molecular formula
- C15H22ClNO
- Average molar mass
- 267.79 g/mol
- Monoisotopic mass
- 267.138992
Names & identifiers
- Preferred name
- 1-{2-[4-(Chloro-ethyl)-phenoxy]-ethyl}-piperidine
- IUPAC
- 1-[2-[4-(2-chloroethyl)phenoxy]ethyl]piperidine
Names & synonyms
SCHEMBL6655030ZQGMEPBICQEXCJ-UHFFFAOYSA-N1-{2-[4-(Chloro-ethyl)-phenoxy]-ethyl}-piperidine
Database identifiers
- PubChem CID
- 54560591
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 211
Related reactions
3 records
Compound notes
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