Compound Identification
SMILES
FC1=C(C=CC(=C1)N1C[C@H](COC2=NC=NC=C2)OC1=O)N1CCN(CC1)C1=NC=C(C=C1)C#N
InChIKey
InChIKey=AYNBKROHBBOWKK-LJQANCHMSA-N
Formula
C24H22FN7O3
Mass
475.484
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 Dialkylarylamines Aniline and substituted anilines 3-pyridinecarbonitriles Fluorobenzenes Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Oxazolidinones Pyrimidines and pyrimidine derivatives Aryl fluorides Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Nitriles Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - 3-pyridinecarbonitrile - Halobenzene - Fluorobenzene - Aminopyridine - Alkyl aryl ether - Oxazolidinone - Pyridine - Aryl fluoride - Pyrimidine - Aryl halide - Imidolactam - Benzenoid - Monocyclic benzene moiety - Carbamic acid ester - Heteroaromatic compound - Oxazolidine - Tertiary amine - Carbonic acid derivative - Azacycle - Oxacycle - Ether - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Amine - Organooxygen compound - 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