<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">65208</id>
  <title nil="true"/>
  <common-name>Methyl-DMA</common-name>
  <description>Methyl-DMA belongs to the phenethylamines, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C12H19N1O2 and an average molecular weight of 209.29 g/mol.</description>
  <cas>54687-43-3</cas>
  <pubchem-id>3048401</pubchem-id>
  <chemical-formula>C12H19N1O2</chemical-formula>
  <weight>209.28</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">2026-04-03T03:57:38Z</created-at>
  <updated-at type="dateTime">2026-08-18T19:57:42Z</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>CNC(C)CC1=C(OC)C=CC(OC)=C1</moldb-smiles>
  <moldb-formula>C12H19N1O2</moldb-formula>
  <moldb-inchi>InChI=1S/C12H19NO2/c1-9(13-2)7-10-8-11(14-3)5-6-12(10)15-4/h5-6,8-9,13H,7H2,1-4H3</moldb-inchi>
  <moldb-inchikey>RSDBPMOXIPCTPN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">209.289</moldb-average-mass>
  <moldb-mono-mass type="decimal">209.141579</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>2310630</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>CHEM061101</chemdb-id>
  <dsstox-id>DTXSID30388848</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00017574</susdat-id>
  <iupac>1-(2,5-dimethoxyphenyl)-N-methylpropan-2-amine</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">4</paper-count>
  <sync-id>CED0045277</sync-id>
  <structure-inchikey>RSDBPMOXIPCTPN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>48000000000000000001800200000000000000000000400000000000000000400000001000000000200000000000000000000000000000020000000000000000000000000000000000000000000000000000000000000100000200000000000000040000000000000040000000100000000000000000000000000000000000000000000040000000000000000000000080000000000000000000000000000000000000000000800004000000080000000000020000000000000000000000000080000000000000000000000000000004000000000000000000000200000000000000000000000000000040000000100000000000000028000000000020010000</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-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:16:33Z</structure-indexed-at>
</compound>
