Compound Identification
SMILES
COC1=CC=CC=C1CCCN1CCN(CC1)C(=O)C1=CC2=C(N1)N=C(N=C2NCCNC(C)=O)C1=CC=CC=C1
InChIKey
InChIKey=ZXFCKFWPAHXWKU-UHFFFAOYSA-N
Formula
C31H37N7O3
Mass
555.683
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropylamines
Alternative Parents
Pyrrolo[2,3-d]pyrimidines 2-heteroaryl carboxamides Anisoles Methoxybenzenes Phenoxy compounds Pyrrole carboxamides N-alkylpiperazines Alkyl aryl ethers Aralkylamines Aminopyrimidines and derivatives Imidolactams Substituted pyrroles Heteroaromatic compounds Acetamides Tertiary carboxylic acid amides Amino acids and derivatives Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpropylamine - Pyrrolopyrimidine - Pyrrolo[2,3-d]pyrimidine - 2-heteroaryl carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxamide - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Aralkylamine - Alkyl aryl ether - N-alkylpiperazine - Aminopyrimidine - Piperazine - Substituted pyrrole - 1,4-diazinane - Imidolactam - Pyrimidine - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Pyrrole - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.
External Descriptors
Not available