Compound Identification
SMILES
OC1CN(C1)C1CCN(CC1)C1=NN=C(NC2=NC=C3C4=C(C=NC=C4)N(C4CCCC4)C3=N2)C=C1
InChIKey
InChIKey=XJDGXENWWHQUCX-UHFFFAOYSA-N
Formula
C26H31N9O
Mass
485.596
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolopyrimidines
- Subclass Pyrrolo[2,3-d]pyrimidines
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Class
Pyrrolopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Pyrrolo[2,3-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolo[2,3-d]pyrimidines
Alternative Parents
Dialkylarylamines Aminopyrimidines and derivatives Aminopyridazines Aminopiperidines Substituted pyrroles Pyridines and derivatives Imidolactams Heteroaromatic compounds Trialkylamines Secondary alcohols Azetidines 1,2-aminoalcohols Secondary amines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolo[2,3-d]pyrimidine - Dialkylarylamine - 4-aminopiperidine - Aminopyridazine - Aminopyrimidine - Piperidine - Pyridazine - Imidolactam - Pyridine - Pyrimidine - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Tertiary amine - Tertiary aliphatic amine - 1,2-aminoalcohol - Azetidine - Secondary alcohol - Azacycle - Secondary amine - Alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.
External Descriptors
Not available