<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">363105</id>
  <title nil="true"/>
  <common-name>5-n-propylpyridine-2,5-diamine</common-name>
  <description>5-n-propylpyridine-2,5-diamine is a chemical compound with the formula C8H13N3. It has an average molecular weight of 151.21 g/mol.</description>
  <cas>1018305-33-3</cas>
  <pubchem-id>28477791</pubchem-id>
  <chemical-formula>C8H13N3</chemical-formula>
  <weight>151.21</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">2026-09-01T12:35:34Z</created-at>
  <updated-at type="dateTime">2026-09-01T12:35:34Z</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>CCCNC1=CN=C(C=C1)N</moldb-smiles>
  <moldb-formula>C8H13N3</moldb-formula>
  <moldb-inchi>InChI=1S/C8H13N3/c1-2-5-10-7-3-4-8(9)11-6-7/h3-4,6,10H,2,5H2,1H3,(H2,9,11)</moldb-inchi>
  <moldb-inchikey>OHTLPJBHHDJKFK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">151.1109474</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.4</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>CHEM358998</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-n-propylpyridine-2,5-diamine</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>Pyridines and derivatives</klass>
  <subklass>Aminopyridines and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0313148</sync-id>
  <structure-inchikey>OHTLPJBHHDJKFK-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000800000000000000000000000000100000000000000000000000002000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000001000000000000000000000000000000020000200000010400000000000000000000000000000000000000000000000000040000000000000000000000080001000000000000000000000000000000000000000000000000000080000002080000000084000000000000000000100000000000000000000000408000000000000000000000040000200000000000000000000000000000040000000000000800000000000000020000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>1008000080200000000000000002000000000000004000000a00042021000044000004000800000000001000288000004200020000c20010000443000a0000084110000020000000080100000620000000101104000010200000420000280000c2004040000020004000000500000002000803001000004511808000031000200400000044000000800000008000000100c00024400200000000800000000000013000000004000000008000024201002c8000000410840000000000001021000000004044002000180000000000000000000000008400000080000080000000000080000000000000000100001200000000010004000020008000058000402</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������h�������@(������@h�������@(������@(������@h�������@h��������h������������������ ��h���h���h���h��	h��
 	�h�B������	��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:59:55Z</structure-indexed-at>
</compound>
