Structure Information
Structure

Compound Identification

SMILES

CC1=C(F)C=C(C=C1)N1CC[C@H](C1)NC(=O)NC1=CC=CC=C1Br

InChIKey

InChIKey=KTUAVJMNKVCKAO-CYBMUJFWSA-N

Formula

C18H19BrFN3O

Mass

392.272

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

N-phenylureas Aminotoluenes Aniline and substituted anilines Dialkylarylamines Fluorobenzenes Bromobenzenes Aryl bromides Aryl fluorides Pyrroles Ureas Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylpyrrolidine - N-phenylurea - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Fluorobenzene - Halobenzene - Toluene - Bromobenzene - Benzenoid - Aryl bromide - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Pyrrole - Urea - Tertiary amine - Azacycle - Amine - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic 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

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