Molecular Identity
fluoxetine
N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
PubChem CID: 3386
N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine is an aromatic ether consisting of 4-trifluoromethylphenol in which the hydrogen of the phenolic hydroxy group is replaced by a 3-(methylamino)-1-phenylpropyl group. It is an aromatic ether, a secondary amino compound and a member of (trifluoromethyl)benzenes.
2D Structure
Properties
C17H18F3NO
Molecular Formula
309.33
Molecular Weight
g/mol
309.1340
Exact Mass
Da
4
XLogP
Drug-like (Lipinski: < 5)
21.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
308
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
fluoxetine54910-89-3FluoxetinaAnimex-OnN-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amineFluvalFluoxetinumFluoxetinFluoxetin ratiopharmMethyl({3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl})amine(+-)-N-Methyl-gamma-(4-(trifluoromethyl)phenoxy)benzenepropanamine(+-)-N-Methyl-3-phenyl-3-((alpha,alpha,alpha-trifluoro-p-tolyl)oxy)propylamine01K63SUP8DDTXSID7023067NSC-758685
Data from PubChem (NCBI)
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