Basic information
- Standard SMILES
CCCCCCCCC#Cc1ccc(CNC(C)c2ccc(C(F)(F)F)cc2)cc1- InChIKey
HYTUEWSCSPDBPA-UHFFFAOYSA-N- Molecular formula
- C26H32F3N
- Average molar mass
- 415.5 g/mol
- Monoisotopic mass
- 415.24868451
Names & identifiers
- Preferred name
- N-(4-dec-1-ynylbenzyl)-N-{1-[4-(trifluoromethyl)phenyl]ethyl}amine
- IUPAC
- N-[(4-dec-1-ynylphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]ethanamine
Names & synonyms
N-(4-dec-1-ynylbenzyl)-N-{1-[4-(trifluoromethyl)phenyl]ethyl}amineSCHEMBL1859891
Database identifiers
- PubChem CID
- 67189397
Properties
Computed structural properties
- XLogP
- 8.5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 513
Related reactions
2 records
Compound notes
Loading…