Compound Identification
SMILES
CC1=CC=C(C=C1)[C@]12[C@@H]3CCCC[C@H]3C(=O)N1C=CC(=O)N2N
InChIKey
InChIKey=NBOWPFPXZLAVMZ-RKVPGOIHSA-N
Formula
C18H21N3O2
Mass
311.385
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Isoindolones Isoindoles Toluenes Pyrrolidine-2-ones Hydropyrimidines Vinylogous amides Tertiary carboxylic acid amides Pyrroles Acrylic acids and derivatives Carboxylic acid hydrazides Lactams Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Toluene - Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrole - Vinylogous amide - Tertiary carboxylic acid amide - Acrylic acid or derivatives - Carboxylic acid hydrazide - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available