Compound Identification
SMILES
FC1=CC(C2=CN=C(N=C2)N2CCCC2)=C(C=C1)N1CCN(CC1)C(=O)CN1CCCCC1=O
InChIKey
InChIKey=UBRKNSVFCODKFV-UHFFFAOYSA-N
Formula
C25H31FN6O2
Mass
466.561
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Phenylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Phenylpiperazines N-arylpiperazines Alpha amino acids and derivatives Aniline and substituted anilines Dialkylarylamines Piperidinones Aminopyrimidines and derivatives Fluorobenzenes Delta lactams Aryl fluorides Tertiary carboxylic acid amides Pyrrolidines Heteroaromatic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - 5-phenylpyrimidine - N-arylpiperazine - Alpha-amino acid or derivatives - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Halobenzene - Fluorobenzene - Piperidinone - Delta-lactam - Aryl fluoride - Aryl halide - 1,4-diazinane - Benzenoid - Piperidine - Piperazine - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Lactam - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available