2-[3-Amino-4-(1-methylethylamino)phenyl]-3-chloro-5-trifluoromethylpyridine
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Basic information
- Standard SMILES
CC(C)Nc1ccc(-c2ncc(C(F)(F)F)cc2Cl)cc1N- InChIKey
KAFQDQWKUIFCSM-UHFFFAOYSA-N- Molecular formula
- C15H15ClF3N3
- Average molar mass
- 329.75 g/mol
Names & identifiers
- Preferred name
- 2-[3-Amino-4-(1-methylethylamino)phenyl]-3-chloro-5-trifluoromethylpyridine
- IUPAC
- 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-N-propan-2-ylbenzene-1,2-diamine
Names & synonyms
2-[3-Amino-4-(1-methylethylamino)phenyl]-3-chloro-5-trifluoromethylpyridineSCHEMBL80090672-[3-amino-4-(1-methylethylamino)-phenyl]-3-chloro-5-trifluoromethylpyridine
Database identifiers
- PubChem CID
- 22114841
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 364
Related reactions
3 records
Compound notes
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