<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">340731</id>
  <title nil="true"/>
  <common-name>2-(1-pentylpiperidin-1-ium-1-yl)ethyl n-(2-pentoxyphenyl)carbamate</common-name>
  <description>2-(1-pentylpiperidin-1-ium-1-yl)ethyl n-(2-pentoxyphenyl)carbamate is a compound with the formula C24H41N2O3+. It has an average molecular weight of 405.60 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3054189</pubchem-id>
  <chemical-formula>C24H41N2O3+</chemical-formula>
  <weight>405.6</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">2026-08-31T00:32:08Z</created-at>
  <updated-at type="dateTime">2026-08-31T00:32:08Z</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>CCCCC[N+]1(CCCCC1)CCOC(=O)NC2=CC=CC=C2OCCCCC</moldb-smiles>
  <moldb-formula>C24H41N2O3+</moldb-formula>
  <moldb-inchi>InChI=1S/C24H40N2O3/c1-3-5-10-16-26(17-11-7-12-18-26)19-21-29-24(27)25-22-14-8-9-15-23(22)28-20-13-6-4-2/h8-9,14-15H,3-7,10-13,16-21H2,1-2H3/p+1</moldb-inchi>
  <moldb-inchikey>BLQAUILTDYDICW-UHFFFAOYSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">405.3117182</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>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>CHEM336624</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-(1-pentylpiperidin-1-ium-1-yl)ethyl n-(2-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>CED0291134</sync-id>
  <structure-inchikey>BLQAUILTDYDICW-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>200400000000000000008000000000000000100000000000000000000000000000000000020000000000000000000000000000000020000010000000000000000000000000000000000100000000000000a0000000000100000008000000000000000020010000000000000000000000000000021000000000000000000004000800000040000000800000000000000080000000200100000080000040000000000000000002000000000001080000002000000008080000002000000002000000000000000000010000000200000000000000408000000000400202000000400000008000000000000040100000010400000000000020000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>501000000d32064081001940012820003000040001052000103500408200080c44020050108000010000410800800000046000a5408c32010020643000a04000c6110c00028006000090510000720200005405805101103240000422000249000c2005261048820008008400d5340001200080500501e0047118020002710002104400980ef0820808020250082c0008111c4816440014021004082000400080004310001090c80000000864017c25100ac000008941084010000a1808c002100010008404400032018004000401028008000000020050000d4000000800020010004810088000001200000340122000005000308042000e0008008050000402</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAHgAAAIABBgBgAAAAAQMGAGAAAAAC
AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgcgIgAAAAEEBgBgAAAAAgIGAGAA
AAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgII
ACgAAAADAgYAKAAAAAMECAAoAAAAAwIHAGgAAAADAgEGQCgAAAADBAZAaAAA
AAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMECAAoAAAA
AwIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAEDCwAB
AAECAAIDAAMEAAQFAAUGAAYHAAcIAAgJAAkKAAULAAsMAAwNAA0OIA4PKAIO
ECAQESAREmgMEhNoDBMUaAwUFWgMFRZoDBYXIBcYABgZABkaABobABscAAoF
ABYRaAxCAgAAAAYGBwgJCgUGEhMUFRYRFwQAAAAAAAAAFg==
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:40:54Z</structure-indexed-at>
</compound>
