<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">332553</id>
  <title nil="true"/>
  <common-name>N-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-n-[3-(trifluoromethyl)phenyl]pyridin-4-amine</common-name>
  <description>N-[3-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-n-[3-(trifluoromethyl)phenyl]pyridin-4-amine is a chemical compound with the formula C22H28F3N3O. It has an average molecular weight of 407.50 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>210934</pubchem-id>
  <chemical-formula>C22H28F3N3O</chemical-formula>
  <weight>407.5</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">2026-08-30T13:45:02Z</created-at>
  <updated-at type="dateTime">2026-08-30T13:45:02Z</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>CC1CN(CC(O1)C)CC(C)CN(C2=CC=NC=C2)C3=CC=CC(=C3)C(F)(F)F</moldb-smiles>
  <moldb-formula>C22H28F3N3O</moldb-formula>
  <moldb-inchi>InChI=1S/C22H28F3N3O/c1-16(12-27-14-17(2)29-18(3)15-27)13-28(20-7-9-26-10-8-20)21-6-4-5-19(11-21)22(23,24)25/h4-11,16-18H,12-15H2,1-3H3</moldb-inchi>
  <moldb-inchikey>RDHHUZKLFMHVMU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">407.218447</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.7</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>CHEM328446</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-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-n-[3-(trifluoromethyl)phenyl]pyridin-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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0283063</sync-id>
  <structure-inchikey>RDHHUZKLFMHVMU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000000000080000200200000000000000000000002000000000000000000108000000000000000000000210000000000000000000000000000000000000000000000000000010000000000000080000000000000000000d000000400000000004000000000000000104000000000020100000000000000000000100011008040000000808000080000000001000000000000800000000000080000000000040000000000000000080002000040000020040000000000000000200000000000000000021000000000040000000000000000000000000200000000010000000000000000082040080000000060800000000000000000000040000000</structure-fingerprint>
  <structure-pattern-fingerprint>501080008d12824081001b408128a0000000140885052000003120428224084c4c020050138000000100410802c0000004600225408d32010024643900a04210c7190c001280040000901040027212020805859051211f3240040462400241000e28052f0048020040000400d5b40008248280700101e0045118084002718002504000080ef0820808060250482c0008191d081244001c82500008a04040008000c310100090c00004000960017d65100ac000008941084010800a1008c00212a01000e404d0022201808480541102800c010030030050000d4010000800030090004810088180001100001151132084005004308042040e1008150050000602</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������� ������`�������`������� ������`�������`�������`�������`�������`�������(������@(������@h�������@h�������@(������@h�������@h�������@(������@h�������@h�������@h�������@(������@h�������� ����	� ����	� ����	� ������������������������������	�	
�	������ �h���h���h���h���h��� ��h���h���h���h���h�����������������h���h�B����������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:34:49Z</structure-indexed-at>
</compound>
