Compound Identification
SMILES
N[C@@H]1COC2=NC(N3CCN(CC3)C(O)=O)=C(F)C=C2C1
InChIKey
InChIKey=DAPNTXADBJICEG-VIFPVBQESA-N
Formula
C13H17FN4O3
Mass
296.302
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 Pyranopyridines Piperazine carboxylic acids Dialkylarylamines Aralkylamines Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Aryl fluorides Heteroaromatic compounds Organic carbonic acids and derivatives Carbamic acids Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Pyridinylpiperazine - Pyranopyridine - Piperazine-1-carboxylic acid - Dialkylarylamine - Aralkylamine - Aminopyridine - Alkyl aryl ether - Imidolactam - Pyridine - Aryl halide - Aryl fluoride - Heteroaromatic compound - Carbonic acid derivative - Carbamic acid derivative - Carbamic acid - Oxacycle - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Carbonyl group - Amine - 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