1-(3-Chloro-5-trifluoromethyl-phenyl)-4-propyl-piperazine
Basic information
- Standard SMILES
CCCN1CCN(c2cc(Cl)cc(C(F)(F)F)c2)CC1- InChIKey
XNZSXENILIIVAU-UHFFFAOYSA-N- Molecular formula
- C14H18ClF3N2
- Average molar mass
- 306.75 g/mol
- Monoisotopic mass
- 306.1110608
Names & identifiers
- Preferred name
- 1-(3-Chloro-5-trifluoromethyl-phenyl)-4-propyl-piperazine
- IUPAC
- 1-[3-chloro-5-(trifluoromethyl)phenyl]-4-propylpiperazine
Names & synonyms
1-(3-Chloro-5-trifluoromethyl-phenyl)-4-propyl-piperazineSCHEMBL2927915
Database identifiers
- PubChem CID
- 9857726
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 303
Related reactions
3 records
Compound notes
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