91795 <common-name>N4-cyclohexyl-2-methyl-N2-(2-methylpropyl)pentane-2,4-diamine</common-name> <description>N4-cyclohexyl-2-methyl-N2-(2-methylpropyl)pentane-2,4-diamine belongs to the cyclohexylamines, a subclass of organonitrogen compounds within the organic compounds. It has the chemical formula C16H34N2 and an average molecular weight of 254.46 g/mol. It is further classified as an organic nitrogen compound.</description> <cas>67990-16-3</cas> <pubchem-id>107030</pubchem-id> <chemical-formula>C16H34N2</chemical-formula> <weight>254.45</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">2026-04-05T01:03:16Z</created-at> <updated-at type="dateTime">2026-08-28T22:00:39Z</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)CNC(C)(C)CC(C)NC1CCCCC1</moldb-smiles> <moldb-formula>C16H34N2</moldb-formula> <moldb-inchi>InChI=1/C16H34N2/c1-13(2)12-17-16(4,5)11-14(3)18-15-9-7-6-8-10-15/h13-15,17-18H,6-12H2,1-5H3</moldb-inchi> <moldb-inchikey>ZYRAUVPYOBILQC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">254.462</moldb-average-mass> <moldb-mono-mass type="decimal">254.2721991</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.5</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>CHEM087688</chemdb-id> <dsstox-id>DTXSID00887090</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00053120</susdat-id> <iupac>4-N-cyclohexyl-2-methyl-2-N-(2-methylpropyl)pentane-2,4-diamine</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>Cyclohexylamines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0141008</sync-id> <structure-inchikey>ZYRAUVPYOBILQC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>60000000000000000000804000002000000000000000000000000000000001000000001000000000000000000000000000800000000800000000000000000000002000000080000000000002000001000000001000000000000000000000000000000000000000400000000000000020000000020000000000000000000000100800000040000000000000000000000080000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000101000000020000000000000800000000000000000000000000000000000200100000000000000000000000000000000000000004020000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAASAAAAEgAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBgBgAAAAAgIHAGAAAAACAQYAIAAAAAQGAGAAAAABAwYAYAAA AAEDBgBgAAAAAgIGAGAAAAADAQYAYAAAAAEDBwBgAAAAAgEGAGAAAAADAQYA YAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgILAAEAAQIA AQMAAwQABAUABQYABQcABQgACAkACQoACQsACwwADA0ADQ4ADg8ADxAAEBEA EQwAQgEAAAAGDBEQDw4NFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:34:05Z</structure-indexed-at> </compound>