Compound Identification
SMILES
CN1CCN(CC1)C1=C(CC2=C(NC3=CC=CC=C23)C(=O)N1)C#N
InChIKey
InChIKey=VATRHXPWSUCWGF-UHFFFAOYSA-N
Formula
C18H19N5O
Mass
321.384
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids and derivatives
Alternative Parents
3-alkylindoles Pyrroloazepines 2-heteroaryl carboxamides Azepines N-methylpiperazines Benzenoids Pyrroles Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Lactams Ketene acetals Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - Pyrroloazepine - 3-alkylindole - Indole - 2-heteroaryl carboxamide - Azepine - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Heteroaromatic compound - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Ketene acetal or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available