Compound Identification
SMILES
COC1=NC=C(C=C1C(F)(F)F)N1CCC2=C(C1)C(N[C@H]1CCNC1)=NC=N2
InChIKey
InChIKey=KLJMPERDUPMWBW-NSHDSACASA-N
Formula
C18H21F3N6O
Mass
394.402
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyridopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyridopyrimidines
Alternative Parents
Dialkylarylamines Secondary alkylarylamines Aralkylamines Aminopyrimidines and derivatives Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Pyrrolidines Heteroaromatic compounds Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Aminopyrimidine - Secondary aliphatic/aromatic amine - Aralkylamine - Imidolactam - Pyrimidine - Pyridine - Heteroaromatic compound - Pyrrolidine - Tertiary amine - Secondary amine - Azacycle - Secondary aliphatic amine - Ether - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available