<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">308745</id>
  <title nil="true"/>
  <common-name>N-[2-(5-methoxy-2,4-dimethyl-1h-indol-3-yl)ethyl]-2-methylprop-2-en-1-amine</common-name>
  <description>N-[2-(5-methoxy-2,4-dimethyl-1h-indol-3-yl)ethyl]-2-methylprop-2-en-1-amine belongs to the tryptamines and derivatives, a subclass of indoles and derivatives within the organic compounds. This organoheterocyclic compound has the chemical formula C17H24N2O and an average molecular weight of 272.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>37920</pubchem-id>
  <chemical-formula>C17H24N2O</chemical-formula>
  <weight>272.4</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">2026-08-29T03:09:39Z</created-at>
  <updated-at type="dateTime">2026-08-29T03:09:39Z</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>CC1=C(C=CC2=C1C(=C(N2)C)CCNCC(=C)C)OC</moldb-smiles>
  <moldb-formula>C17H24N2O</moldb-formula>
  <moldb-inchi>InChI=1S/C17H24N2O/c1-11(2)10-18-9-8-14-13(4)19-15-6-7-16(20-5)12(3)17(14)15/h6-7,18-19H,1,8-10H2,2-5H3</moldb-inchi>
  <moldb-inchikey>YNHCLTYRSVBUDV-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">272.1888634</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.9</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>CHEM304638</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>N-[2-(5-methoxy-2,4-dimethyl-1h-indol-3-yl)ethyl]-2-methylprop-2-en-1-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>Organoheterocyclic compounds</superklass>
  <klass>Indoles and derivatives</klass>
  <subklass>Tryptamines and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0259763</sync-id>
  <structure-inchikey>YNHCLTYRSVBUDV-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800200000104000000000000000000000000000000480000000000000000000000000000000000000000000000000800008000000000401000000000000000000000000000000000001000000900000000000000000000000000010000000040000000000000000000000000002000002000000800420000000040000000000000200000000080004000000000000000001000000000000080000080000000000200080000000000000080000000000000000000000080000000000000000000000000000000000000000000002000004200000000000000000000000000000040000000000000001008000020008000000001002000</structure-fingerprint>
  <structure-pattern-fingerprint>500002100922820080000140010820000180140001052004003420408200808c54220050128000000000410a00800000042100ac808c32410002643000a04000c6130400121006000092101013620200000405915301133240000722102011021c3804070048820020008000d4140201200680708109c0041119282802110012024400484cd88208080612408a2c0008393c8812448014830022084020c0008400c310001010c0000a000948017c2d100ac000008943084818a04210084042100000008404000a13018000001401028004000000024050200d0002040800030010100e10000102040000041311522000081020309042000e4008100052000002</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������@h�������@h�������@(������@(������@(������@(������@8��������`�������`�������`�������`�������`�������(�������h��������`�������(�������`�����������h���h���h���h���h���h���h��	h��
����������������������� �����h�	�h�B���������������	�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:16:37Z</structure-indexed-at>
</compound>
