Compound Identification
SMILES
CCC1=CC=CC(C)=C1NC(=O)C[NH+]1CCN(CC1)C1=[NH+]C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=RBZMBRSIRCHCJJ-UHFFFAOYSA-P
Formula
C21H27F3N4O
Mass
408.468
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Pyridinylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpiperazines
Alternative Parents
Alpha amino acid amides N-arylpiperazines N-piperazineacetamides Anilides N-arylamides Dialkylarylamines Toluenes Aminopyridines and derivatives N-alkylpiperazines Pyridinium derivatives Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Alkyl fluorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - N-arylpiperazine - Pyridinylpiperazine - Alpha-amino acid or derivatives - N-piperazineacetamide - Anilide - Dialkylarylamine - N-arylamide - Aminopyridine - N-alkylpiperazine - Toluene - Pyridine - Pyridinium - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Quaternary ammonium salt - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Carboxylic acid derivative - Azacycle - Alkyl fluoride - Alkyl halide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available