<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">278758</id>
  <title nil="true"/>
  <common-name>5-[(2s)-1-methylpyrrolidin-2-yl]-2,5-dihydropyridine</common-name>
  <description>5-[(2s)-1-methylpyrrolidin-2-yl]-2,5-dihydropyridine belongs to the hydropyridines, a subclass of pyridines and derivatives within the organic compounds. It is categorized as an organoheterocyclic compound with the formula C10H16N2. The compound has an average molecular weight of 164.25 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>90658037</pubchem-id>
  <chemical-formula>C10H16N2</chemical-formula>
  <weight>164.25</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">2026-08-26T18:41:28Z</created-at>
  <updated-at type="dateTime">2026-08-26T18:41:28Z</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>CN1CCCC1C2C=CCN=C2</moldb-smiles>
  <moldb-formula>C10H16N2</moldb-formula>
  <moldb-inchi>InChI=1S/C10H16N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,8-10H,3,5-7H2,1H3/t9?,10-/m0/s1</moldb-inchi>
  <moldb-inchikey>FHQCTCOXKBQXGN-AXDSSHIGSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">164.1313485</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>CHEM274651</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-[(2s)-1-methylpyrrolidin-2-yl]-2,5-dihydropyridine</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>Hydropyridines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0230840</sync-id>
  <structure-inchikey>FHQCTCOXKBQXGN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>200000000000000000020000000000000082000000004000000020010000002000100000000000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000020100000000000000080000100800000040000010000000000080004000000000000000000000000000000000000000000004000000000000080000000000000001000000008000000000020000000000000000000000000080000000000000400000000000000000000000000000000000000000000040000000002000000040000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�����������������������€���`������� ������`�������`�������`�������`�������`�������h��������h��������`�������(�������h���������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:54:13Z</structure-indexed-at>
</compound>
