Compound Identification
SMILES
N=C1N2[C@@H]3CCC[C@H]4[C@@H]3C4=CC[C@@]1(C#N)[C@H](C#N)C2=O
InChIKey
InChIKey=HTOFFXIALJAEGN-NZIXVDBUSA-N
Formula
C15H14N4O
Mass
266.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass N-alkylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
N-alkylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
N-alkylpyrrolidines
Alternative Parents
Pyrrolidine-2-ones Tertiary amines Lactams Amino acids and derivatives Nitriles Carboximidamides Carboxamidines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Amino acid or derivatives - Lactam - Tertiary amine - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Carbonitrile - Nitrile - Carboximidamide - Azacycle - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-alkylpyrrolidines. These are compounds containing a pyrrolidine moiety that is substituted at the N1-position with an alkyl group. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available