Basic information
- Standard SMILES
CNCCCc1nc2c(OC(F)(F)F)cccc2[nH]1- InChIKey
MSYIDOAFBVFOKM-UHFFFAOYSA-N- Molecular formula
- C12H14F3N3O
- Average molar mass
- 273.25 g/mol
- Monoisotopic mass
- 273.10889656
Names & identifiers
- Preferred name
- Methyl-[3-(4-trifluoromethoxy-1H-benzoimidazol-2-yl)-propyl]-amine
- IUPAC
- N-methyl-3-[4-(trifluoromethoxy)-1H-benzimidazol-2-yl]propan-1-amine
Names & synonyms
Methyl-[3-(4-trifluoromethoxy-1H-benzoimidazol-2-yl)-propyl]-amineSCHEMBL2844507
Database identifiers
- PubChem CID
- 68413403
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 288
Related reactions
1 records
Compound notes
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