<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">73176</id>
  <title nil="true"/>
  <common-name>N,N-Diethyl-2,5-diethoxyaniline</common-name>
  <description>N,N-Diethyl-2,5-diethoxyaniline belongs to the aminophenyl ethers, a subclass of phenol ethers within the organic compounds. It is a member of the benzenoids superclass with the formula C14H23N1O2. This compound has an average molecular weight of 237.34 g/mol.</description>
  <cas>35945-16-5</cas>
  <pubchem-id>118897</pubchem-id>
  <chemical-formula>C14H23N1O2</chemical-formula>
  <weight>237.34</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">2026-04-03T23:15:26Z</created-at>
  <updated-at type="dateTime">2026-08-19T07:34:26Z</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>CCOC1=CC(N(CC)CC)=C(OCC)C=C1</moldb-smiles>
  <moldb-formula>C14H23N1O2</moldb-formula>
  <moldb-inchi>InChI=1S/C14H23NO2/c1-5-15(6-2)13-11-12(16-7-3)9-10-14(13)17-8-4/h9-11H,5-8H2,1-4H3</moldb-inchi>
  <moldb-inchikey>XXJMDOIBGIZHNR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">237.343</moldb-average-mass>
  <moldb-mono-mass type="decimal">237.172879</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.5</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>106242</chemspider-id>
  <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>CHEM069069</chemdb-id>
  <dsstox-id>DTXSID7067952</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00029954</susdat-id>
  <iupac>2,5-diethoxy-N,N-diethylaniline</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>Phenol ethers</klass>
  <subklass>Aminophenyl ethers</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0173478</sync-id>
  <structure-inchikey>XXJMDOIBGIZHNR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400800200000000000000000000080000000000000400000000000002010000200000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000300000200000000000000000000000000000000000000104000000000000800000040000000000000000000000040000000000000000000000000000000000000000000020000000000000000000000000000000000080000000000000000080000000000040000000000000000000000000010000000000000000001000000000000000200000000000000000000000000000040000000000000000000000020000000000020000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(������@(������@h�������@(�������(�������`�������`�������`�������`������@(�������(�������`�������`������@h�������@h��������������� ��h���h��� �������	�	
���h��� ������h���h���h�B���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:21:57Z</structure-indexed-at>
</compound>
