Basic information
- Standard SMILES
C[C@@H](N)c1cnc(C(F)(F)F)nc1.Cl.Cl- InChIKey
VWERKMNGJNDXKA-RZFWHQLPSA-N- Molecular formula
- C7H10Cl2F3N3
- Average molar mass
- 264.07 g/mol
- Monoisotopic mass
- 263.0203872
Names & identifiers
- Preferred name
- (1R)-1-[2-(trifluoromethyl)pyrimidin-5-yl]ethanamine dihydrochloride
- IUPAC
- (1R)-1-[2-(trifluoromethyl)pyrimidin-5-yl]ethanamine;dihydrochloride
Names & synonyms
(1R)-1-[2-(trifluoromethyl)pyrimidin-5-yl]ethanamine dihydrochlorideSCHEMBL452127
Database identifiers
- PubChem CID
- 66690185
Properties
Computed structural properties
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 163
Related reactions
2 records
Compound notes
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