<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">313387</id>
  <title nil="true"/>
  <common-name>N-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide</common-name>
  <description>N-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide is a chemical compound with the formula C18H22N4O. It has an average molecular weight of 310.40 g/mol.</description>
  <cas>86523-85-5</cas>
  <pubchem-id>3070506</pubchem-id>
  <chemical-formula>C18H22N4O</chemical-formula>
  <weight>310.4</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">2026-08-29T10:09:04Z</created-at>
  <updated-at type="dateTime">2026-08-29T10:09:04Z</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>C1CN(CCN1CCC(=O)NC2=CC=CC=C2)C3=CC=CC=N3</moldb-smiles>
  <moldb-formula>C18H22N4O</moldb-formula>
  <moldb-inchi>InChI=1S/C18H22N4O/c23-18(20-16-6-2-1-3-7-16)9-11-21-12-14-22(15-13-21)17-8-4-5-10-19-17/h1-8,10H,9,11-15H2,(H,20,23)</moldb-inchi>
  <moldb-inchikey>BOVSCTXJYWTIMU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">310.1793613</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.9</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>CHEM309280</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-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide</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>CED0264296</sync-id>
  <structure-inchikey>BOVSCTXJYWTIMU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000208000000000000000000000000001000000000000000000000000000000000000000000000020040001000000000080000000000000000001200000000000000000000000000000200000000000010000000000000000000000000100000000000000004100000400000201000000000000000000000000000000000004008000000000000040900001000001000000000000000000000000000000000000000000200a000000000000000008000000a000000800000000000008000000000000000000000000000000000000000000000200000000010000008000000000002040000000000400000000000000200000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>411080000912064080000900010820000000040000052000003100420214080c4802005000800000000041080288000004200025c08d30010220643000a04010c6110c000280040000901000006200000005019050010132400004220002c8000c200526004002000400040055150008200080700101c00471980a0002710002004000180ee0800808020240082c0008111d0812444034020000080000400080085310000010c00000000940057c25300ac80000884108401000020008c00210001000c404400222018080040401028000000000020840000d0800000800020000000810000000000000001240032000001000308042000e0008108058000606</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������`�������`������� ������`�������`�������(�������(�������h�������@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@(�������������������������������	(��
 
� ��h��h��h���h���h��� ��h���h���h���h���h������h���h�B����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:20:07Z</structure-indexed-at>
</compound>
