<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">279575</id>
  <title nil="true"/>
  <common-name>2-[2-[2-methylpropyl(propan-2-yl)amino]ethyl]guanidine</common-name>
  <description>2-[2-[2-methylpropyl(propan-2-yl)amino]ethyl]guanidine belongs to the guanidines, a subclass of organonitrogen compounds within the organic compounds. It is classified as an organic nitrogen compound with the formula C10H24N4 and an average molecular weight of 200.32 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>56854</pubchem-id>
  <chemical-formula>C10H24N4</chemical-formula>
  <weight>200.32</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">2026-08-26T19:30:23Z</created-at>
  <updated-at type="dateTime">2026-08-26T19:30:23Z</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)CN(CCN=C(N)N)C(C)C</moldb-smiles>
  <moldb-formula>C10H24N4</moldb-formula>
  <moldb-inchi>InChI=1S/C10H24N4/c1-8(2)7-14(9(3)4)6-5-13-10(11)12/h8-9H,5-7H2,1-4H3,(H4,11,12,13)</moldb-inchi>
  <moldb-inchikey>JFSOHBAFGGSTPE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">200.2000968</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>CHEM275468</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-[2-[2-methylpropyl(propan-2-yl)amino]ethyl]guanidine</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Guanidines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0231629</sync-id>
  <structure-inchikey>JFSOHBAFGGSTPE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000080000800000000000000880000000000000000000000000000000001020000000000000010000000000000000000000000000000000000000000080000000000000000000000000000000000000000000000004000000000000000000010000000004000000044000000000000000000000002000000000000000000040000000000000080000000000001000000000000000000000000000000000000000000000000000000000000000000000000000080000000000000000000000200000000000000000000000000000000000000000008000000000000000000000000100080000000000000002000001000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAOAAAADQAAAIABBgBgAAAAAQMGAGAAAAAD
AQYAYAAAAAEDBgBgAAAAAgIHACAAAAADBgBgAAAAAgIGAGAAAAACAgcAKAAA
AAMDBgAoAAAAAwQHAGgAAAADAQIHAGgAAAADAQIGAGAAAAADAQYAYAAAAAED
BgBgAAAAAQMLAAEAAQIAAQMAAwQABAUABQYABgcABwgoAggJIAgKIAQLAAsM
AAsNAEIAAAAAFwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:54:51Z</structure-indexed-at>
</compound>
