<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">313246</id>
  <title nil="true"/>
  <common-name>6-[(3-propan-2-ylphenyl)methyl]-7,8-dihydro-5h-1,6-naphthyridine</common-name>
  <description>6-[(3-propan-2-ylphenyl)methyl]-7,8-dihydro-5h-1,6-naphthyridine is a chemical compound with the formula C18H22N2. It has an average molecular weight of 266.40 g/mol.</description>
  <cas>75509-90-9</cas>
  <pubchem-id>3058708</pubchem-id>
  <chemical-formula>C18H22N2</chemical-formula>
  <weight>266.4</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">2026-08-29T09:59:42Z</created-at>
  <updated-at type="dateTime">2026-08-29T09:59:42Z</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>CC(C)C1=CC=CC(=C1)CN2CCC3=C(C2)C=CC=N3</moldb-smiles>
  <moldb-formula>C18H22N2</moldb-formula>
  <moldb-inchi>InChI=1S/C18H22N2/c1-14(2)16-6-3-5-15(11-16)12-20-10-8-18-17(13-20)7-4-9-19-18/h3-7,9,11,14H,8,10,12-13H2,1-2H3</moldb-inchi>
  <moldb-inchikey>GMQOJTAZKSHBHM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">266.1782987</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.4</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>CHEM309139</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>6-[(3-propan-2-ylphenyl)methyl]-7,8-dihydro-5h-1,6-naphthyridine</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>Diazanaphthalenes</klass>
  <subklass>Naphthyridines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0264159</sync-id>
  <structure-inchikey>GMQOJTAZKSHBHM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000000000080000000000000000000000100000000000000000000000000100000000000000000000000200000000000000000800000100000000000000000000000000000020000000000000000000000000100000000008000000000000000000000000000000010000000000002010000000000000000000000000d100040200000800000000000000000000000000000000000080000000000000000000000000000000400080000000000000000080000008000000000020000000000000400000000000000000000000400000008000000200220041000010008000000000000002040000000000000200028000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������@(������@h�������@h�������@h�������@(������@h��������`������� ������`�������`������@(������@(�������`������@h�������@h�������@h�������@(�����������������h���h���h���h���h��	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:20:01Z</structure-indexed-at>
</compound>
