<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">304451</id>
  <title nil="true"/>
  <common-name>5-[[bis(2-methylpropyl)amino]methyl]-3-butan-2-yl-1,3-oxazolidin-2-one</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>3040568</pubchem-id>
  <chemical-formula>C16H32N2O2</chemical-formula>
  <weight>284.44</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">2026-08-28T21:56:59Z</created-at>
  <updated-at type="dateTime">2026-08-28T21:56:59Z</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>CCC(C)N1CC(OC1=O)CN(CC(C)C)CC(C)C</moldb-smiles>
  <moldb-formula>C16H32N2O2</moldb-formula>
  <moldb-inchi>InChI=1S/C16H32N2O2/c1-7-14(6)18-11-15(20-16(18)19)10-17(8-12(2)3)9-13(4)5/h12-15H,7-11H2,1-6H3</moldb-inchi>
  <moldb-inchikey>ODOKATONQCCCPL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">284.2463783</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>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>CHEM300344</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-[[bis(2-methylpropyl)amino]methyl]-3-butan-2-yl-1,3-oxazolidin-2-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>Azolidines</klass>
  <subklass>Oxazolidines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0255588</sync-id>
  <structure-inchikey>ODOKATONQCCCPL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000000000000000000000000000000000000000500004001002000020000400000000000000000000000000000002000000000000000000000000000000000002800000000020800001000400000000001002000000000000000000002000002000044000000000020100000000000000000000104000000040000000000000000000000000000000000000000000000000000000000000200000000000000000080100000000000000000000000000000000000000800000000001000000000000000200000000000000000000000000000000000000000000000100080000000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������(�������`�������`�������(�������(�������(�������`������� ������`�������`�������`�������`�������`�������`�������`�������`����������������������������� �	(��
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������������������������� B��������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:13:29Z</structure-indexed-at>
</compound>
