Compound Identification
SMILES
CC1=C(C=CC=N1)C(C#N)N1CCN(CC1)C(=O)OC(C)(C)C
InChIKey
InChIKey=KXXLXUWALCKUAV-UHFFFAOYSA-N
Formula
C17H24N4O2
Mass
316.405
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
- Subclass Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Piperazine carboxylic acids and derivatives
Direct Parent
Piperazine carboxylic acids
Alternative Parents
N-alkylpiperazines Methylpyridines Aralkylamines Heteroaromatic compounds Carbamate esters Trialkylamines Alpha-aminonitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Piperazine-1-carboxylic acid - Methylpyridine - Aralkylamine - N-alkylpiperazine - Pyridine - Heteroaromatic compound - Carbamic acid ester - Alpha-aminonitrile - Tertiary amine - Tertiary aliphatic amine - Carbonitrile - Nitrile - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperazine carboxylic acids. These are heterocyclic compounds containing a piperazine ring substituted by one or more carboxylic acid groups.
External Descriptors
Not available