Compound Identification
SMILES
CCN1CCCC[C@@H]1C1=NC2=C(N1CC1=CC=C(C=C1)C(F)(F)F)C(NCCC1CCC1)=NC(=N2)C(O)=O
InChIKey
InChIKey=NSRNNDRCIFZEQA-HXUWFJFHSA-N
Formula
C27H33F3N6O2
Mass
530.596
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Imidazopyrimidines
-
Subclass
Purines and purine derivatives
-
Level 5
6-aminopurines
- Level 6 6-alkylaminopurines
-
Level 5
6-aminopurines
-
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
6-aminopurines
Direct Parent
6-alkylaminopurines
Alternative Parents
Trifluoromethylbenzenes Pyrimidinecarboxylic acids Aminopyrimidines and derivatives Aralkylamines Piperidines N-substituted imidazoles Imidolactams Heteroaromatic compounds Trialkylamines Amino acids Azacyclic compounds Carboxylic acids Alkyl fluorides Organic oxides Organofluorides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-alkylaminopurine - Trifluoromethylbenzene - Pyrimidine-2-carboxylic acid - Pyrimidine-2-carboxylic acid or derivatives - Aminopyrimidine - Aralkylamine - Monocyclic benzene moiety - Imidolactam - Benzenoid - N-substituted imidazole - Piperidine - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Amino acid - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Organic oxide - Alkyl halide - Alkyl fluoride - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6-alkylaminopurines. These are compounds that contain an alkylamine group attached at the 6-position of a purine. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available