140228 <common-name>JNJ-39758979</common-name> <description>JNJ-39758979 belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This compound has the chemical formula C11H19N5 and an average molecular weight of 221.31 g/mol. It is further classified as an organic nitrogen compound.</description> <cas>1046447-90-8</cas> <pubchem-id>24994634</pubchem-id> <chemical-formula>C11H19N5</chemical-formula> <weight>221.3</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">2026-04-15T16:17:24Z</created-at> <updated-at type="dateTime">2026-08-18T12:39:02Z</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>DB18899</drugbank-id> <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(=NC(N)=N1)N1CC[C@@H](N)C1</moldb-smiles> <moldb-formula>C11H19N5</moldb-formula> <moldb-inchi>InChI=1S/C11H19N5/c1-7(2)9-5-10(15-11(13)14-9)16-4-3-8(12)6-16/h5,7-8H,3-4,6,12H2,1-2H3,(H2,13,14,15)/t8-/m1/s1</moldb-inchi> <moldb-inchikey>COOGVHJHSCBOQT-MRVPVSSYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">221.308</moldb-average-mass> <moldb-mono-mass type="decimal">221.164045632</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.7</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>CHEM136121</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>4-[(3R)-3-aminopyrrolidin-1-yl]-6-propan-2-ylpyrimidin-2-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">79</paper-count> <sync-id>CED0020515</sync-id> <structure-inchikey>COOGVHJHSCBOQT-MRVPVSSYSA-N</structure-inchikey> <structure-fingerprint>40000000800000000000000000000000000000000000000000000000000000000000001000000000000100000000002000000140000000000000000000000400000100000000024000200200000000000000000000000000000000001000000000000000000000000200000000100000000000020100000000000000000000100000000440200000000000000000000000001000000000000000008000000000000400000004000000000000080000000000000000004000008008000000000000000000000000000000000000080000000000000000000000000000000000000000000000800001020040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEQAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBkAoAAAAAwQGQGgAAAADAwEGQCgAAAADBAdAKAAAAAMDBkAo AAAAAwQHAGgAAAADAQIHQCgAAAADAwcAKAAAAAMDBgBgAAAAAgIGAGAAAAAC AgYgNAAAAAEBBAcAYAAAAAECBgBgAAAAAgILAAEAAQIAAQMAAwRoDAQFaAwF BmgMBgdoDAcIIAcJaAwFCiAKCwALDAAMDQANDgANDwAJA2gMDwoAQgIAAAAG AwkHBgUEBQsKDw0MFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:51:13Z</structure-indexed-at> </compound>