Compound Identification
SMILES
CC1=C2N3CCNCC3CC(=O)NC2=CC=C1
InChIKey
InChIKey=CPIACSIAARCMQC-UHFFFAOYSA-N
Formula
C13H17N3O
Mass
231.299
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
-
Level 5
Aminotoluenes
- Level 6 Diaminotoluenes
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Level 5
Aminotoluenes
-
Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Aminotoluenes
Direct Parent
Diaminotoluenes
Alternative Parents
Dialkylarylamines 1,4-diazepines Piperazines Secondary carboxylic acid amides Lactams Amino acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diaminotoluene - Dialkylarylamine - Para-diazepine - 1,4-diazinane - Piperazine - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diaminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group exactly 2 amino groups.
External Descriptors
Not available