Basic information
- Standard SMILES
CCCCCCCCCCCc1noc(-c2ccc(CNC(C)(C)c3ccc(C(F)(F)F)cc3)cc2)n1- InChIKey
MLDZNMWZPKMPSA-UHFFFAOYSA-N- Molecular formula
- C30H40F3N3O
- Average molar mass
- 515.7 g/mol
- Monoisotopic mass
- 515.31234739
Names & identifiers
- Preferred name
- N-{1-methyl-1-[4-(trifluoromethyl)phenyl]ethyl}-N-[4-(3-undecyl-1,2,4-oxadiazol-5-yl)benzyl]amine
- IUPAC
- 2-[4-(trifluoromethyl)phenyl]-N-[[4-(3-undecyl-1,2,4-oxadiazol-5-yl)phenyl]methyl]propan-2-amine
Names & synonyms
N-{1-methyl-1-[4-(trifluoromethyl)phenyl]ethyl}-N-[4-(3-undecyl-1,2,4-oxadiazol-5-yl)benzyl]amineSCHEMBL1850471
Database identifiers
- PubChem CID
- 67185463
Properties
Computed structural properties
- XLogP
- 9.7
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 15
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 614
Related reactions
2 records
Compound notes
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