Compound Identification
SMILES
CC1=C(NC(=O)NC2=CN=C3C=CC(=NN23)N2CCC[C@@H]2C2=C(F)C=CC(F)=C2)C(C)=NO1
InChIKey
InChIKey=BIMXQSQMCRDMNQ-QGZVFWFLSA-N
Formula
C22H21F2N7O2
Mass
453.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Dialkylarylamines Aminopyridazines Fluorobenzenes Aryl fluorides Imidolactams N-substituted imidazoles Isoxazoles Heteroaromatic compounds Pyrroles Ureas Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Dialkylarylamine - Aminopyridazine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - N-substituted imidazole - Pyridazine - Heteroaromatic compound - Azole - Imidazole - Isoxazole - Pyrrole - Urea - Tertiary amine - Oxacycle - Azacycle - Organofluoride - Organohalogen compound - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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