Compound Identification
SMILES
CC1=CC=C(C=C1)[C@H]1C[C@@H](N2NC=C(C(=O)NC3CCCCC3)C2=N1)C(F)(F)F
InChIKey
InChIKey=DMHLSUUSAMODTJ-QZTJIDSGSA-N
Formula
C21H25F3N4O
Mass
406.453
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolopyrimidines
Alternative Parents
Pyrimidinecarboxamides Toluenes Imidolactams Hydropyrimidines Vinylogous amides Pyrazolines Pyrazoles Secondary carboxylic acid amides Amidrazones Propargyl-type 1,3-dipolar organic compounds Amidines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Pyrazolopyrimidine - Toluene - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Imidolactam - Benzenoid - Pyrimidine - Vinylogous amide - Pyrazole - Pyrazoline - Carboxylic acid amidrazone - Carboxamide group - Secondary carboxylic acid amide - Amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Organic oxide - Carbonyl group - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolopyrimidines. These are compounds containing a pyrazolopyrimidine skeleton, which consists of a pyrazole fused to a pyrimidine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyrimidine is 6-membered ring consisting of four carbon atoms and two adjacent nitrogen atoms at the 1- and 3- ring position.
External Descriptors
Not available