Compound Identification
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)N1CCN(CC1)C1=C(C=CC=N1)C#N
InChIKey
InChIKey=PMRKMUQBQDONPI-SFHVURJKSA-N
Formula
C22H23FN6O3
Mass
438.463
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
Phenylpiperazines N-arylpiperazines 3-pyridinecarbonitriles Aniline and substituted anilines Dialkylarylamines Aminopyridines and derivatives Fluorobenzenes Oxazolidinones Imidolactams Aryl fluorides Acetamides Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Oxacyclic compounds Nitriles Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - 3-pyridinecarbonitrile - Aniline or substituted anilines - Aminopyridine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Oxazolidinone - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Acetamide - Carbamic acid ester - Oxazolidine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - 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