Compound Identification
SMILES
NC1=NC(=O)C2=C(NCN(CCCN3CCOCC3)C2)N1
InChIKey
InChIKey=MSLRFMDLSHJTEO-UHFFFAOYSA-N
Formula
C13H22N6O2
Mass
294.359
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidones
Alternative Parents
Secondary alkylarylamines Aminopyrimidines and derivatives Morpholines Vinylogous amides Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Morpholine - Oxazinane - Heteroaromatic compound - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Secondary amine - Oxacycle - Azacycle - Primary amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. 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