Compound Identification
SMILES
CN1CNC2C1C(=O)N(C)C(=O)N2C
InChIKey
InChIKey=QISGHOCVHLUEOE-UHFFFAOYSA-N
Formula
C8H14N4O2
Mass
198.226
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
-
Subclass
Purines and purine derivatives
- Level 5 Xanthines
-
Subclass
Purines and purine derivatives
-
Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Xanthines
Alternative Parents
Purinones Alpha amino acids and derivatives Alkaloids and derivatives Pyrimidones N-acyl ureas Diazinanes Imidazolidines Dicarboximides Dialkylamines Azacyclic compounds Aminals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Xanthine - Alpha-amino acid or derivatives - Purinone - Alkaloid or derivatives - N-acyl urea - Ureide - Pyrimidone - 1,3-diazinane - Pyrimidine - Dicarboximide - Imidazolidine - Amino acid or derivatives - Urea - Carbonic acid derivative - Aminal - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.
External Descriptors
Not available