<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">19047</id>
  <title nil="true"/>
  <common-name>3-(Aminomethyl)pyridine</common-name>
  <description>3-(Aminomethyl)pyridine is an organic nitrogen compound with the chemical formula C6H8N2 and an average molecular weight of 108.14 g/mol. 3-(Aminomethyl)pyridine belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This compound is found in or released from three recorded sources, specifically electrical and electronic equipment including radio transmission systems, antennas, and still video cameras.</description>
  <cas>3731-52-0</cas>
  <pubchem-id>31018</pubchem-id>
  <chemical-formula>C6H8N2</chemical-formula>
  <weight>108.14</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">2016-05-22T04:46:04Z</created-at>
  <updated-at type="dateTime">2026-08-23T14:55:07Z</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>DB19769</drugbank-id>
  <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>NCC1=CN=CC=C1</moldb-smiles>
  <moldb-formula>C6H8N2</moldb-formula>
  <moldb-inchi>InChI=1S/C6H8N2/c7-4-6-2-1-3-8-5-6/h1-3,5H,4,7H2</moldb-inchi>
  <moldb-inchikey>HDOUGSFASVGDCS-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">108.1411</moldb-average-mass>
  <moldb-mono-mass type="decimal">108.068748266</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>28777</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>CHEM017942</chemdb-id>
  <dsstox-id>DTXSID2044424</dsstox-id>
  <toxcast-id>44424</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00030177</susdat-id>
  <iupac>pyridin-3-ylmethanamine</iupac>
  <moldb-polar-surface-area>38.91</moldb-polar-surface-area>
  <moldb-refractivity>32.374500000000005</moldb-refractivity>
  <moldb-polarizability>11.654611374696234</moldb-polarizability>
  <moldb-rotatable-bond-count>1</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>1</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>8.949638577810408</moldb-pka-strongest-basic>
  <moldb-physiological-charge>1</moldb-physiological-charge>
  <moldb-number-of-rings>1</moldb-number-of-rings>
  <moldb-alogps-logp>-0.43</moldb-alogps-logp>
  <moldb-alogps-logs>0.10</moldb-alogps-logs>
  <moldb-alogps-solubility>1.37e+02 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer">66</paper-count>
  <sync-id>CED0021649</sync-id>
  <structure-inchikey>HDOUGSFASVGDCS-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000000000000000000000000000000000000000000000000002000000000000004000000000000000000000000000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000000000000000000000400000000000000100000200000800000000000000000001000000000000000000000000000000000000000000000000000080000000000000000000000000000000000000100000000000020001000000000000000000000000000000000000a20000000000000000000000800002040000004000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>80000000000000000000000020000000000000040000000000420200000440000000008000000000010002000000042000200004200000004420002000008011000002000000000000000042000000010110400001020000002000000000042004040000000000000000500000002000003001000000111808000011000200400000040000000800000008000000102c00024400008000000800000000000003000000004000000008000000000002c0000000400840000000000000001000000000040002000180000004000000000000000000400000000000080000000000000000010000000000100003000000000000044000020000000050000002</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������@(������@h�������@(������@h�������@h�������@h���������������h���h���h���h���h���h�B���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:07:25Z</structure-indexed-at>
</compound>
