<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">348661</id>
  <title nil="true"/>
  <common-name>N,3-bis(1-adamantyloxy)-2-ethyl-6-methylpyridin-4-amine</common-name>
  <description>N,3-bis(1-adamantyloxy)-2-ethyl-6-methylpyridin-4-amine is a chemical compound with the formula C28H40N2O2. It has an average molecular weight of 436.60 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>64613</pubchem-id>
  <chemical-formula>C28H40N2O2</chemical-formula>
  <weight>436.6</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">2026-08-31T12:46:06Z</created-at>
  <updated-at type="dateTime">2026-08-31T12:46:06Z</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>CCC1=NC(=CC(=C1OC23CC4CC(C2)CC(C4)C3)NOC56CC7CC(C5)CC(C7)C6)C</moldb-smiles>
  <moldb-formula>C28H40N2O2</moldb-formula>
  <moldb-inchi>InChI=1S/C28H40N2O2/c1-3-24-26(31-27-11-18-5-19(12-27)7-20(6-18)13-27)25(4-17(2)29-24)30-32-28-14-21-8-22(15-28)10-23(9-21)16-28/h4,18-23H,3,5-16H2,1-2H3,(H,29,30)</moldb-inchi>
  <moldb-inchikey>FGSYJRVZUJNEIS-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">436.3089785</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>7.4</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>CHEM344554</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>N,3-bis(1-adamantyloxy)-2-ethyl-6-methylpyridin-4-amine</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 oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Ethers</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0298991</sync-id>
  <structure-inchikey>FGSYJRVZUJNEIS-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>80000000000000000000000000000000000000000000001000004200000000040000040000200420000000080000000000000000000000000000000000000000000000000040000000800100010000000000000000000000000004000000a0000000001000000000000200000000000000000000001000000000480000000000000000000010800000000000000000800000000000000008000000000000000000000800000000000000020000004000000000008000000000000000000000000000000000000000000810000020100000020000000001000000000000010000400000c0000000000000000000800000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>7036c0108d32c27081d85b66c1b8b2805ac0144391052010827d60628224684c7c22001013f0100001484908c2c00000157046a4408d326539ee7539eaa04110df110c8c3285368000905040137a23006855c59153611e3742841d6240a25385ec78452f104ca2216a2e8480ddb4024d30868172e109e50f71182c54a2510302524590094efc9608491613d0c82d0288391d9a5254449f9a50230e2864c1048400d330b611b2f3220b06096aa16d75144ee42443a941084010b04ab04cc04212a08110ac44f40b333980c4a2d79143918c4160b0034470208d6122862a20032291b86b547881453611088413d91ba1868c502630d0c2250f970cb34956100e02</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ���������������� ���&amp;���€���`�������`������@(������@(������@(������@h�������@(������@(�������(������� ������`�������`�������`�������`�������`�������`�������`�������`�������`�������h�������� ������ ������`�������`�������`�������`�������`�������`�������`�������`�������`�������`��������������h���h���h���h���h��� �	�	
�
���������������������� ��������������������������������������h��	��	�������������B	�����������
���	�
����	�����������������������������	��������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:46:57Z</structure-indexed-at>
</compound>
