Compound Identification
SMILES
O=C(NC1=CC=C(C=C1)N1CCCC1)N1CCC(CC1)C1=NC=NC2=C1C=CC(OCCN1CCCC1=O)=C2
InChIKey
InChIKey=WUVLMWIGMDSTGT-UHFFFAOYSA-N
Formula
C30H36N6O3
Mass
528.657
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
N-phenylureas Quinazolines Piperidinecarboxamides Aniline and substituted anilines Dialkylarylamines Phenol ethers Alkyl aryl ethers N-alkylpyrrolidines Pyrimidines and pyrimidine derivatives Pyrrolidine-2-ones Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Ureas Lactams Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - N-phenylurea - Quinazoline - 1-piperidinecarboxamide - Piperidinecarboxamide - Phenol ether - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Monocyclic benzene moiety - Piperidine - Pyrimidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - N-alkylpyrrolidine - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Urea - Tertiary amine - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Ether - Amine - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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