<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365238</id>
  <title nil="true"/>
  <common-name>5-(4-methylpiperazin-1-yl)-1h-pyrimidin-6-one</common-name>
  <description>5-(4-methylpiperazin-1-yl)-1h-pyrimidin-6-one is a chemical compound with the formula C9H14N4O. It has an average molecular weight of 194.23 g/mol.</description>
  <cas>153004-47-8</cas>
  <pubchem-id>3073824</pubchem-id>
  <chemical-formula>C9H14N4O</chemical-formula>
  <weight>194.23</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">2026-09-01T15:44:10Z</created-at>
  <updated-at type="dateTime">2026-09-01T15:44:10Z</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>CN1CCN(CC1)C2=CN=CNC2=O</moldb-smiles>
  <moldb-formula>C9H14N4O</moldb-formula>
  <moldb-inchi>InChI=1S/C9H14N4O/c1-12-2-4-13(5-3-12)8-6-10-7-11-9(8)14/h6-7H,2-5H2,1H3,(H,10,11,14)</moldb-inchi>
  <moldb-inchikey>JEURZSJNEJLJSR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">194.1167611</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.6</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>CHEM361131</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-(4-methylpiperazin-1-yl)-1h-pyrimidin-6-one</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>Diazinanes</klass>
  <subklass>Piperazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315195</sync-id>
  <structure-inchikey>JEURZSJNEJLJSR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000000000000000010000000000000000000000010000010000800000000000000020000000000000002000000100000000000000000000000000000000000000000000000000000000000020000000000000004000000002000000000000020000000000000000000000000000020100000000040000000000000000000040000000000000200000004000000000000000000000080000000000000100000000000000000000080000000000000000000001008000000800000100000000000000001000000000000000000000000000000000000000000000000000000000000000000040000000000000000200000800000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������(�������`�������`������@(������@h�������@(������@h�������@8�������@(�������(�������������������������� ��h��	h�	
h�
�h���h��(������h�B�������������	
�������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T06:01:22Z</structure-indexed-at>
</compound>
