<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">306986</id>
  <title nil="true"/>
  <common-name>3-(furan-2-yl)-n-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]propanamide</common-name>
  <description>3-(furan-2-yl)-n-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]propanamide belongs to the phenethylamines, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the chemical formula C17H18F3NO2 and an average molecular weight of 325.32 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3056717</pubchem-id>
  <chemical-formula>C17H18F3NO2</chemical-formula>
  <weight>325.32</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-29T00:53:59Z</created-at>
  <updated-at type="dateTime">2026-08-29T00:53:59Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)CCC2=CC=CO2</moldb-smiles>
  <moldb-formula>C17H18F3NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C17H18F3NO2/c1-12(21-16(22)8-7-15-6-3-9-23-15)10-13-4-2-5-14(11-13)17(18,19)20/h2-6,9,11-12H,7-8,10H2,1H3,(H,21,22)</moldb-inchi>
  <moldb-inchikey>LVSYXVCHLYNAKL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">325.1289633</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.8</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM302879</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>3-(furan-2-yl)-n-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]propanamide</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Phenethylamines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0258038</sync-id>
  <structure-inchikey>LVSYXVCHLYNAKL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000004000000001800040002400000000000000000000000000000002000000001000000000000000000000000000000000000000000000002000000000000000000000000000000000000000000020800000000000000000000000000000001000014000000000000000100001000000000000000000000000000000000001000040200000800000000000000080000000000000000000401000080000000000000000000000000080080000000040000100040020000000000002280000000008000000000000000000000000000000000000004080000220000000000000000000000000000040000000000402820000000000000200000060000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������@(������@h�������@(������@h�������@h�������@h�������� ����	� ����	� ����	� ������h��������(�������(�������`�������`������@(������@h�������@h�������@h�������@(�����������������h���h���h���h���h��	�	
�	��	����� ��(������������h���h���h���h���h���h�B���������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:15:19Z</structure-indexed-at>
</compound>
