<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">281725</id>
  <title nil="true"/>
  <common-name>2-(diethylamino)-n-[(e)-(5-nitrofuran-2-yl)methylideneamino]acetamide</common-name>
  <description>2-(diethylamino)-n-[(e)-(5-nitrofuran-2-yl)methylideneamino]acetamide belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This compound has the chemical formula C11H16N4O4 and an average molecular weight of 268.27 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>9570735</pubchem-id>
  <chemical-formula>C11H16N4O4</chemical-formula>
  <weight>268.27</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">2026-08-27T17:06:10Z</created-at>
  <updated-at type="dateTime">2026-08-27T17:06:10Z</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>CCN(CC)CC(=O)NN=CC1=CC=C(O1)[N+](=O)[O-]</moldb-smiles>
  <moldb-formula>C11H16N4O4</moldb-formula>
  <moldb-inchi>InChI=1S/C11H16N4O4/c1-3-14(4-2)8-10(16)13-12-7-9-5-6-11(19-9)15(17)18/h5-7H,3-4,8H2,1-2H3,(H,13,16)/b12-7+</moldb-inchi>
  <moldb-inchikey>ZLJFETGNYMBBMT-KPKJPENVSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">268.117155</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.6</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>CHEM277618</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>2-(diethylamino)-n-[(e)-(5-nitrofuran-2-yl)methylideneamino]acetamide</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>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0233683</sync-id>
  <structure-inchikey>ZLJFETGNYMBBMT-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000008000000000000000000000000000000000000000001100020100020000020000000000080000000000000000000000000000000000000000000000000000000000000000000000208000000002000010040000004000000000000100000002000000808040000000000808000000000000000000000000100000c0000000000000000000000080000000021000008000000000000000000000000000000000000000080000000000000000000000000000200000000000000000000000000800000000000100000000000000000000000200000000002000002000000000001048000000000400000000001000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������(�������(�������h��������(�������h�������@(������@h�������@h�������@(������@(������ *��������(������ *���ÿ�����������������������(��� �	 	
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� ��h��h��h���h��� ��(��� ��h�B�������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:56:42Z</structure-indexed-at>
</compound>
