Compound Identification
SMILES
OC(=O)C1=C(N=CC=C1)N1CCN2[C@@H](CC[C@@H]2C#CC2=CC(Cl)=CC=C2)C1
InChIKey
InChIKey=LGDPZIBUBSIOJQ-ROUUACIJSA-N
Formula
C21H20ClN3O2
Mass
381.86
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
N-arylpiperazines Pyridinecarboxylic acids Dialkylarylamines Aminopyridines and derivatives N-alkylpiperazines Chlorobenzenes Aryl chlorides N-alkylpyrrolidines Imidolactams Vinylogous amides Heteroaromatic compounds Trialkylamines Amino acids Azacyclic compounds Carboxylic acids Organooxygen compounds Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dialkylarylamine - Aminopyridine - Chlorobenzene - Halobenzene - N-alkylpiperazine - Imidolactam - Benzenoid - N-alkylpyrrolidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Vinylogous amide - Pyrrolidine - Tertiary amine - Amino acid - Tertiary aliphatic amine - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organochloride - Aromatic heteropolycyclic 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