Responsive image

Common name


Dexfenfluramine

IUPAC name


ethyl[(2S)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]amine

SMILES


CCN[C@@H](C)CC1=CC=CC(=C1)C(F)(F)F

Compound class


Serotonin Uptake Inhibitors; Anti-Obesity Agents; Serotonin Receptor Agonists; Alimentary Tract and Metabolism; Centrally Acting Antiobesity Products; Antiobesity Preparations, Excl. Diet Products; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C19 Inducers; CYP2A6 Inhibitors; CYP2A6 Inhibitors (strong); CYP2A6 Inhibitors (moderate); CYP2A6 Inducers; CYP2A6 Inducers (strong); CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP2E1 Inhibitors; CYP2E1 Inducers; CYP2E1 Inducers (strong);

Therapeutic area


For the management of obesity including weight loss and maintenance of weight loss in patients on a reduced calorie diet.

Common name


Dexfenfluramine

IUPAC name


ethyl[(2S)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]amine

SMILES


CCN[C@@H](C)CC1=CC=CC(=C1)C(F)(F)F

INCHI


InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3/t9-/m0/s1

FORMULA


C12H16F3N

Responsive image

Common name


Dexfenfluramine

IUPAC name


ethyl[(2S)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]amine

Molecular weight


231.257

clogP


3.802

clogS


-4.370

HBond Acceptor


0

HBond Donor


1

Total Polar
Surface Area


12.03

Number of Rings


1

Rotatable Bond


5

Drug ID Common name Structure CAS SMILE Frequency
FDBF00005 benzene Responsive image c1ccccc1 0.2824
FDBF00007 propane Responsive image C(C)C 0.2412
FDBF00040 ethanamine Responsive image CCN 0.0677
FDBF00070 N-ethylethanamine Responsive image N(CC)CC 0.0240
FDBF00177 fluoroform Responsive image FC(F)F 0.0704
FDBF00193 propylbenzene Responsive image C(c1ccccc1)CC 0.0186
FDBF00208 propan-2-amine Responsive image CC(N)C 0.0210
FDBF00243 N-ethylpropan-2-amine Responsive image C(C)(C)NCC 0.0045
FDBF02711 (2S)-1-phenylpropan-2-amine Responsive image C(C)(Cc1ccccc1)N 0.0010
12 , 2