Compound Identification
SMILES
[O-]C(=NC1=NC=NN1)[C@H]1CN(C(=O)C1)C1=CC(Br)=CC=C1
InChIKey
InChIKey=QZQNHZUSUOSCMR-MRVPVSSYSA-M
Formula
C13H11BrN5O2
Mass
349.169
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Bromobenzenes Aryl bromides Pyrrolidine-2-ones Triazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Amino acids and derivatives Tertiary amines Lactams Carboximidic acids Azacyclic compounds Organic oxides Carbonyl compounds Organobromides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - 2-pyrrolidone - Azole - Pyrrole - Heteroaromatic compound - 1,2,4-triazole - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Lactam - Carboximidic acid derivative - Carboximidic acid - Azacycle - Carboxylic acid derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic anion - 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