Compound Identification
SMILES
CCN(C1CCN(CC1)C1=NC(=NO1)[C@@H]1CCCO1)C(=O)C1=CN=C(N=C1)N1C[C@H](N)[C@H](C1)C1=C(F)C=CC(C)=C1
InChIKey
InChIKey=QPYPGKSXQIIUJP-VJTSUQJLSA-N
Formula
C29H37FN8O3
Mass
564.666
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Pyrimidinecarboxamides Dialkylarylamines Toluenes Aminopyrimidines and derivatives Aralkylamines Fluorobenzenes Piperidines Aryl fluorides Tertiary carboxylic acid amides Pyrroles Oxolanes 1,2,4-oxadiazoles Heteroaromatic compounds Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monoalkylamines Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyrrolidine - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - Dialkylarylamine - Aminopyrimidine - Fluorobenzene - Halobenzene - Aralkylamine - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Pyrimidine - 1,2,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Oxolane - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Organonitrogen compound - Primary amine - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Amine - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organofluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available