Compound Identification
SMILES
CC(C)(C)C12CC(CN1)N(C2C(O)=O)C1=NN(C2=C1C(Cl)=CC=C2)C1=CC(NCC2=CC=CC=C2)=NC=C1
InChIKey
InChIKey=JNFNIBIEHJWAMS-UHFFFAOYSA-N
Formula
C29H31ClN6O2
Mass
531.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzylamines
- Level 5 2-benzylaminopyridines
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Subclass
Benzylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylamines
Intermediate Tree Nodes
Not available
Direct Parent
2-benzylaminopyridines
Alternative Parents
N-arylpiperazines Alpha amino acids and derivatives Piperazine carboxylic acids Indazoles Pyrrolidine carboxylic acids Dialkylarylamines Aminopyridines and derivatives Imidolactams Aryl chlorides Pyrazoles Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzylaminopyridine - N-arylpiperazine - Alpha-amino acid or derivatives - Indazole - Piperazine-2-carboxylic acid - Benzopyrazole - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Dialkylarylamine - Aminopyridine - 1,4-diazinane - Piperazine - Pyridine - Aryl chloride - Aryl halide - Imidolactam - Heteroaromatic compound - Pyrrolidine - Pyrazole - Azole - Amino acid or derivatives - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzylaminopyridines. These are aromatic compounds containing pyridine ring substituted at the 2-position by a benzylamine group.
External Descriptors
Not available