<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">297961</id>
  <title nil="true"/>
  <common-name>5-(6,7-dimethyl-6-azabicyclo[3.2.1]octan-1-yl)benzene-1,3-diol</common-name>
  <description>5-(6,7-dimethyl-6-azabicyclo[3.2.1]octan-1-yl)benzene-1,3-diol belongs to the cyclohexylphenols, a subclass of benzene and substituted derivatives within the organic compounds. It is categorized under the benzenoids superclass. This compound has the formula C15H21NO2 and an average molecular weight of 247.33 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3045744</pubchem-id>
  <chemical-formula>C15H21NO2</chemical-formula>
  <weight>247.33</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">2026-08-28T14:18:07Z</created-at>
  <updated-at type="dateTime">2026-08-28T14:18:07Z</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>CC1C2(CCCC(C2)N1C)C3=CC(=CC(=C3)O)O</moldb-smiles>
  <moldb-formula>C15H21NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C15H21NO2/c1-10-15(5-3-4-12(9-15)16(10)2)11-6-13(17)8-14(18)7-11/h6-8,10,12,17-18H,3-5,9H2,1-2H3</moldb-inchi>
  <moldb-inchikey>VRWQFJFRMYXBTD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">247.1572289</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.8</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>CHEM293854</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>5-(6,7-dimethyl-6-azabicyclo[3.2.1]octan-1-yl)benzene-1,3-diol</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>Cyclohexylphenols</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0249331</sync-id>
  <structure-inchikey>VRWQFJFRMYXBTD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40100000000000000000000000000000000000010100000000000000000000000000000000100000000000000000100000000000000000000000000000000000000000000008200000000000000000000000000001000000000000020040000000000000010000000000000000100000000000020100000000000000000000100800000048000000000000000000004000200000000000008000000000000000000000040004000000000000880000000000000000000000000000000000000000000000000000002000000000000001000000000000000000000002000000000000000000000000000040000000020000000000000010010040000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������`�������`������� ������`������@(������@h�������@(������@h�������@(������@h��������h��������h��������������������������������	��
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  <structure-indexed-at type="dateTime">2026-09-19T05:08:40Z</structure-indexed-at>
</compound>
