Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CCC(=O)N(C2CCN(CC2)C(=O)NC2=CC=CC=C2C(F)(F)F)C2=CC=CC=C2)CC1

InChIKey

InChIKey=LAWIBIMUMIPXPO-UHFFFAOYSA-N

Formula

C27H34F3N5O2

Mass

517.597

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - N-phenylurea - Trifluoromethylbenzene - 1-piperidinecarboxamide - Piperidinecarboxamide - Anilide - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Piperidine - Benzenoid - Tertiary carboxylic acid amide - Tertiary amine - Urea - Tertiary aliphatic amine - Carboxamide group - Organoheterocyclic compound - Azacycle - Alkyl fluoride - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl halide - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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