Compound Identification
SMILES
COC1=CC=C(C=C1)C1NC(=O)N(C)C2=C1C(=O)N(CCN1CCCCC1)C2
InChIKey
InChIKey=HBQQVQVDNAOUHE-UHFFFAOYSA-N
Formula
C21H28N4O3
Mass
384.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrimidines
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Pyrimidones Alkyl aryl ethers Piperidines Hydropyrimidines Vinylogous amides Tertiary carboxylic acid amides Pyrrolines Ureas Trialkylamines Lactams Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Piperidine - Pyrimidine - Benzenoid - Pyrroline - Vinylogous amide - Tertiary carboxylic acid amide - Urea - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Lactam - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Amine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one 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