Compound Identification
SMILES
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@H](C2)C1=CC(N)=C(F)N=C1
InChIKey
InChIKey=SDEAHCQAZSOLLL-DMDPSCGWSA-N
Formula
C16H22FN3O2
Mass
307.369
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Epibatidine analogues
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Epibatidine analogues
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Epibatidine analogues
Alternative Parents
Pyrrolidinylpyridines Pyrrolidine carboxylic acids Aminopyridines and derivatives 2-halopyridines Aryl fluorides Heteroaromatic compounds Carbamate esters Azacyclic compounds Primary amines Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Epibatidine-skeleton - Pyrrolidinylpyridine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 2-halopyridine - Aminopyridine - Aryl fluoride - Aryl halide - Pyridine - Heteroaromatic compound - Carbamic acid ester - Pyrrolidine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Amine - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as epibatidine analogues. These are compounds containing an epibatidine moiety, with a structure characterized by a 2-chloropyridine moiety connected to an 7-azabicyclo[2.2.1]heptane in exo position.
External Descriptors
Not available