Compound Identification
SMILES
NC1=NC(=O)C2=C(N1)N(COCCOC(=O)C1=CC(CN3CCCCC3)=CC=C1)C=N2
InChIKey
InChIKey=XEELMGDNTYTFSI-UHFFFAOYSA-N
Formula
C21H26N6O4
Mass
426.477
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Piperidines
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Subclass
Benzylpiperidines
- Level 5 N-benzylpiperidines
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Subclass
Benzylpiperidines
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-benzylpiperidines
Alternative Parents
6-oxopurines Benzoic acid esters Hypoxanthines Benzoyl derivatives Benzylamines Phenylmethylamines Pyrimidones Aralkylamines Aminopyrimidines and derivatives N-substituted imidazoles Heteroaromatic compounds Vinylogous amides Carboxylic acid esters Amino acids and derivatives Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylpiperidine - 6-oxopurine - Benzoate ester - Hypoxanthine - Benzoic acid or derivatives - Imidazopyrimidine - Purine - Benzoyl - Benzylamine - Phenylmethylamine - Aminopyrimidine - Aralkylamine - Pyrimidone - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Pyrimidine - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Tertiary amine - Carboxylic acid ester - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.
External Descriptors
Not available