Compound Identification
SMILES
CNCCCC1(OCC2=C1C=CC(=C2)C#N)C1=CC=C(F)C=C1
InChIKey
InChIKey=PTJADDMMFYXMMG-UHFFFAOYSA-N
Formula
C19H19FN2O
Mass
310.372
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Isocoumarans Fluorobenzenes Aralkylamines Aryl fluorides Oxacyclic compounds Nitriles Dialkylamines Dialkyl ethers Organopnictogen compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Isocoumaran - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Dialkyl ether - Secondary aliphatic amine - Ether - Carbonitrile - Nitrile - Oxacycle - Secondary amine - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
CHEBI:80603 : organic amino compound - benzenes