<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">317799</id>
  <title nil="true"/>
  <common-name>3-(1-methylpyrrol-2-yl)-n-[(e)-(4-propan-2-ylphenyl)methylideneamino]-1h-pyrazole-5-carboxamide</common-name>
  <description>3-(1-methylpyrrol-2-yl)-n-[(e)-(4-propan-2-ylphenyl)methylideneamino]-1h-pyrazole-5-carboxamide is a chemical compound with the formula C19H21N5O. It has an average molecular weight of 335.40 g/mol.</description>
  <cas>303095-22-9</cas>
  <pubchem-id>6030423</pubchem-id>
  <chemical-formula>C19H21N5O</chemical-formula>
  <weight>335.4</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">2026-08-29T15:59:32Z</created-at>
  <updated-at type="dateTime">2026-08-29T15:59:32Z</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)C1=CC=C(C=C1)C=NNC(=O)C2=CC(=NN2)C3=CC=CN3C</moldb-smiles>
  <moldb-formula>C19H21N5O</moldb-formula>
  <moldb-inchi>InChI=1S/C19H21N5O/c1-13(2)15-8-6-14(7-9-15)12-20-23-19(25)17-11-16(21-22-17)18-5-4-10-24(18)3/h4-13H,1-3H3,(H,21,22)(H,23,25)/b20-12+</moldb-inchi>
  <moldb-inchikey>VAUZQBNADQXJIY-UDWIEESQSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">335.1746103</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3</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>CHEM313692</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>3-(1-methylpyrrol-2-yl)-n-[(e)-(4-propan-2-ylphenyl)methylideneamino]-1h-pyrazole-5-carboxamide</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>Lipids and lipid-like molecules</superklass>
  <klass>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0268612</sync-id>
  <structure-inchikey>VAUZQBNADQXJIY-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>60000040000000000020000100000000008100000000000000000000000000000002001000000402000000000000002020000000000000000000000002000000000000000000400000000300000000000020000000000200000004000000000000000000010000200000000080100000000100080100000000000800000000000000000040000000800400200000004080000800000000000000000000000000000000000000000000000400080000004000000000000000000200000000000400000000000000000000000000000000000000080000000000000200000000000008000000000004001040000000000400000000000000000080080000004000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������@(������@h�������@h�������@(������@h�������@h��������h��������(�������h��������(�������(������@(������@h�������@(������@(������@8�������@(������@h�������@h�������@h�������@(�������`�����������������h���h���h���h���h��	 	
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  <structure-indexed-at type="dateTime">2026-09-19T05:23:30Z</structure-indexed-at>
</compound>
