<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">284776</id>
  <title nil="true"/>
  <common-name>N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-n-methylprop-2-yn-1-amine</common-name>
  <description>N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-n-methylprop-2-yn-1-amine belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This organic nitrogen compound has the formula C12H17N and an average molecular weight of 175.27 g/mol.</description>
  <cas>16381-87-6</cas>
  <pubchem-id>204475</pubchem-id>
  <chemical-formula>C12H17N</chemical-formula>
  <weight>175.27</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">2026-08-27T20:24:54Z</created-at>
  <updated-at type="dateTime">2026-08-27T20:24:54Z</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>CN(CC#C)CC1CC2CC1C=C2</moldb-smiles>
  <moldb-formula>C12H17N</moldb-formula>
  <moldb-inchi>InChI=1S/C12H17N/c1-3-6-13(2)9-12-8-10-4-5-11(12)7-10/h1,4-5,10-12H,6-9H2,2H3</moldb-inchi>
  <moldb-inchikey>KUEPGIOCLJRWFI-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">175.1360995</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2</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>CHEM280669</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-bicyclo[2.2.1]hept-5-enylmethyl)-n-methylprop-2-yn-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>Organic nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0236626</sync-id>
  <structure-inchikey>KUEPGIOCLJRWFI-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>200000802000000000020000000000000000000000200000000000400000000000000000000000000000000000000000000000000000000000000000000200000000000004004000000000000020000000000000000000000004000020000000002000800000004000000010020000000000020000000000100000000040000010000000000000000000100000000000000000080000000000000800000400000000000000100400000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000100000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�����������������������€���`������� ������`�������(�������h��������`�������`�������`�������`�������`�������`�������h��������h���������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:58:57Z</structure-indexed-at>
</compound>
