<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">320067</id>
  <title nil="true"/>
  <common-name>2-(diethylamino)ethyl n-(2-methyl-4-pentoxyphenyl)carbamate</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>46134</pubchem-id>
  <chemical-formula>C19H32N2O3</chemical-formula>
  <weight>336.5</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">2026-08-29T18:49:02Z</created-at>
  <updated-at type="dateTime">2026-08-29T18:49:02Z</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>CCCCCOC1=CC(=C(C=C1)NC(=O)OCCN(CC)CC)C</moldb-smiles>
  <moldb-formula>C19H32N2O3</moldb-formula>
  <moldb-inchi>InChI=1S/C19H32N2O3/c1-5-8-9-13-23-17-10-11-18(16(4)15-17)20-19(22)24-14-12-21(6-2)7-3/h10-11,15H,5-9,12-14H2,1-4H3,(H,20,22)</moldb-inchi>
  <moldb-inchikey>KJRQROOOENUTDU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">336.2412929</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.4</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>CHEM315960</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)ethyl n-(2-methyl-4-pentoxyphenyl)carbamate</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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Phenylcarbamic acid esters</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0270824</sync-id>
  <structure-inchikey>KJRQROOOENUTDU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000800000000000000010000000000000000000000000100000000002000000200000000000000000000000000000000000000000000000000000000000000000010000000800000020000000000100000200000001000000000020010000000000000000104000000000000800000000000000000004000020000040000000000000000000000080000000000800000080000040000000000040000002000000000000080100000000000028080000002000040000000000000000000000000000000000000000080000000000002000000202000000000000008000000000800040000000010400000001000000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>400000000932060080000100010820003000040000052000103420400200000c40020050008000010000410000800000042000a5008c30010000743000a04080c6110400020006000090108000620000000401804001013240000422000209000c200406004082000000000055340001200080500101e0045118020002310002104400980ee0800808020244082c0008111c4816440014820004080000400080004310001010c00000000844017c25100ac000008841084010000200084002100010008404400012018000000401028000000000020040000d0000000800030000000810020100000200000200822000001000308042000e0008008050000402</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������(������@(������@h�������@(������@(������@h�������@h��������h��������(�������(�������(�������`�������`������� ������`�������`�������`�������`�������`����������������������� ��h���h��	h�	
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	������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:25:21Z</structure-indexed-at>
</compound>
