4-(4-methoxyphenoxy)-N,N-dimethyl-6-(trifluoromethyl)pyrimidin-2-amine
Basic information
- CAS
338792-44-2- Standard SMILES
COc1ccc(Oc2cc(C(F)(F)F)nc(N(C)C)n2)cc1- InChIKey
JYUQQNLQPMXQTG-UHFFFAOYSA-N- Molecular formula
- C14H14F3N3O2
- Average molar mass
- 313.27 g/mol
- Monoisotopic mass
- 313.10381118
Names & identifiers
- Preferred name
- 4-(4-methoxyphenoxy)-N,N-dimethyl-6-(trifluoromethyl)pyrimidin-2-amine
- IUPAC
- 4-(4-methoxyphenoxy)-N,N-dimethyl-6-(trifluoromethyl)pyrimidin-2-amine
Names & synonyms
4-(4-methoxyphenoxy)-N,N-dimethyl-6-(trifluoromethyl)pyrimidin-2-amine338792-44-24-(4-methoxyphenoxy)-N,N-dimethyl-6-(trifluoromethyl)-2-pyrimidinamineMLS000696139CHEMBL1414105DTXSID301154221HMS2651C24AKOS0050975156G-419SSMR000333491
Database identifiers
- CAS
338792-44-2- PubChem CID
- 3255159
- DTXSID
DTXSID301154221- ChEMBL
CHEMBL1414105
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 47.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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