6-chloro-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
Basic information
- CAS
1023813-53-7- Standard SMILES
CNc1cc(Cl)nc(C(F)(F)F)n1- InChIKey
SAGGJJYJLWSBIG-UHFFFAOYSA-N- Molecular formula
- C6H5ClF3N3
- Average molar mass
- 211.57 g/mol
- Monoisotopic mass
- 211.0124094
Names & identifiers
- Preferred name
- 6-chloro-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
- IUPAC
- 6-chloro-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
Names & synonyms
6-chloro-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine1023813-53-7SCHEMBL15360303SAGGJJYJLWSBIG-UHFFFAOYSA-NDTXSID601211357SB591376-Chloro-N-methyl-2-(trifluoromethyl)-4-pyrimidinamine
Database identifiers
- CAS
1023813-53-7- PubChem CID
- 33697948
- DTXSID
DTXSID601211357
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 175
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Compound notes
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