Compound Identification
SMILES
FC(F)(F)C(=O)OC1CCN(CC2=CC=C(C=C2)C(=O)NN(C2CCCCC2)C2=NC(=NC=C2Br)C#N)CC1
InChIKey
InChIKey=GQDGGJWMXIYBJG-UHFFFAOYSA-N
Formula
C26H28BrF3N6O3
Mass
609.448
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Piperidines
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Subclass
Benzylpiperidines
- Level 5 N-benzylpiperidines
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Subclass
Benzylpiperidines
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-benzylpiperidines
Alternative Parents
Benzoic acids and derivatives Phenylmethylamines Benzoyl derivatives Benzylamines Aralkylamines Halopyrimidines Aryl bromides Imidolactams Alpha-halocarboxylic acid derivatives Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid hydrazides Carboxylic acid esters Nitriles Azacyclic compounds Monocarboxylic acids and derivatives Organofluorides Alkyl fluorides Organic oxides Organobromides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzylpiperidine - Benzoic acid or derivatives - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - Halopyrimidine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Carboxylic acid hydrazide - Nitrile - Monocarboxylic acid or derivatives - Carbonitrile - Azacycle - Carboxylic acid derivative - Organofluoride - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Alkyl fluoride - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.
External Descriptors
Not available