Compound Identification
SMILES
CC(C)N1C=C(C(=O)C2=CN=CC(N[C@@H]3CCN([C@@H]3C3=CC=CC=C3)C(C)=O)=N2)C2=C1N=CN=C2N
InChIKey
InChIKey=WAJYOJVNNBMVIM-AUSIDOKSSA-N
Formula
C26H28N8O2
Mass
484.564
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Pyrazine carboxylic acids and derivatives Pyrrolo[2,3-d]pyrimidines Aryl ketones N-acylpyrrolidines Aminopyrimidines and derivatives Aminopyrazines Imidolactams Benzene and substituted derivatives Substituted pyrroles Vinylogous amides Heteroaromatic compounds Acetamides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Pyrrolo[2,3-d]pyrimidine - Pyrazine carboxylic acid or derivatives - Pyrrolopyrimidine - N-acylpyrrolidine - Aryl ketone - Aminopyrazine - Aminopyrimidine - Monocyclic benzene moiety - Pyrazine - Pyrimidine - Imidolactam - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Acetamide - Vinylogous amide - Pyrrole - Tertiary carboxylic acid amide - Ketone - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - 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