Compound Identification
SMILES
CC1=NC(NCC2=C(C)C(CN(CC([O-])=O)CC([O-])=O)=C(C)C(CNC3=CC=CC(C)=N3)=C2C)=CC=C1
InChIKey
InChIKey=XGXXOLUXMPXSBQ-UHFFFAOYSA-L
Formula
C28H33N5O4
Mass
503.604
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Alpha amino acids Phenylmethylamines Aminopyridines and derivatives Aralkylamines Methylpyridines Dicarboxylic acids and derivatives Imidolactams Heteroaromatic compounds Trialkylamines Carboxylic acid salts Amino acids Carboxylic acids Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-benzylaminopyridine - Alpha-amino acid - Alpha-amino acid or derivatives - Phenylmethylamine - Aminopyridine - Methylpyridine - Aralkylamine - Dicarboxylic acid or derivatives - Pyridine - Imidolactam - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid salt - Amino acid - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic anion - Aromatic heteromonocyclic 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