365483 <common-name>1-[2-(1,2,4-triazol-1-yl)ethyl]piperidine</common-name> <description>1-[2-(1,2,4-triazol-1-yl)ethyl]piperidine is a chemical compound with the formula C9H16N4. It has an average molecular weight of 180.25 g/mol.</description> <cas>51444-29-2</cas> <pubchem-id>3039955</pubchem-id> <chemical-formula>C9H16N4</chemical-formula> <weight>180.25</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">2026-09-01T16:05:59Z</created-at> <updated-at type="dateTime">2026-09-01T16:05:59Z</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>C1CCN(CC1)CCN2C=NC=N2</moldb-smiles> <moldb-formula>C9H16N4</moldb-formula> <moldb-inchi>InChI=1S/C9H16N4/c1-2-4-12(5-3-1)6-7-13-9-10-8-11-13/h8-9H,1-7H2</moldb-inchi> <moldb-inchikey>ADTVDDSTSYXXPE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">180.1374965</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.8</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>CHEM361376</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>1-[2-(1,2,4-triazol-1-yl)ethyl]piperidine</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>Piperidines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0315436</sync-id> <structure-inchikey>ADTVDDSTSYXXPE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000100000000080000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000040000000000000080000000000000000000000001000000000000000000000001000000000000000000000000000000000000004000002090000000000000000000000880000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000000200004000000000a000000000000000000000000000001800000000000000000000000400000000000000000000010000000000000000000040000000000000000000000000000002000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ���������������� �������€���`�������`�������`������� ������`�������`�������`�������`������@(������@h�������@(������@h�������@(������������������������������� h� h� �h���h������h�B������������ ��� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:33Z</structure-indexed-at> </compound>