Compound Identification
SMILES
OCCN1CCC(CC1)N1CNC2=CCC=C(N=C12)N1CCOCC1
InChIKey
InChIKey=HXASXHCKOCBGAP-UHFFFAOYSA-N
Formula
C18H29N5O2
Mass
347.463
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Azepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azepines
Alternative Parents
Imidolactams Morpholines Piperidines Imidazolidines Ketene acetals 1,2-aminoalcohols Trialkylamines Carboxamidines Oxacyclic compounds Azacyclic compounds Enamines Dialkyl ethers Carboximidamides Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Azepine - Morpholine - Imidolactam - Oxazinane - Piperidine - Imidazolidine - 1,2-aminoalcohol - Ketene acetal or derivatives - Tertiary amine - Tertiary aliphatic amine - Alkanolamine - Amidine - Carboxylic acid amidine - Dialkyl ether - Enamine - Ether - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Alcohol - Primary alcohol - Amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as azepines. These are organic compounds containing an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available