284349 <common-name>Methyl 2-pyrrolidin-3-ylbenzoate</common-name> <description>Methyl 2-pyrrolidin-3-ylbenzoate belongs to the phenylpyrrolidines, a subclass of pyrrolidines within the organic compounds. It is an organoheterocyclic compound with the formula C12H15NO2 and an average molecular weight of 205.25 g/mol.</description> <cas>1121058-19-2</cas> <pubchem-id>66628647</pubchem-id> <chemical-formula>C12H15NO2</chemical-formula> <weight>205.25</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">2026-08-27T19:59:11Z</created-at> <updated-at type="dateTime">2026-08-27T19:59:11Z</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>COC(=O)C1=CC=CC=C1C2CCNC2</moldb-smiles> <moldb-formula>C12H15NO2</moldb-formula> <moldb-inchi>InChI=1S/C12H15NO2/c1-15-12(14)11-5-3-2-4-10(11)9-6-7-13-8-9/h2-5,9,13H,6-8H2,1H3</moldb-inchi> <moldb-inchikey>ASAPISFCAQAERO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">205.1102787</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.5</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>CHEM280242</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>Methyl 2-pyrrolidin-3-ylbenzoate</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>Organoheterocyclic compounds</superklass> <klass>Pyrrolidines</klass> <subklass>Phenylpyrrolidines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0236228</sync-id> <structure-inchikey>ASAPISFCAQAERO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000000000000000000000004000000000000000100000000000000000000000020000000000000000000000000000000000000000000060000002000100000000000000000000000000010000000040000000000000002000020080000000000000000000101000000040000000801000200000000080000010000100000000000000000000100000080004000000000000080000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000000040000400000400000000000000000100800000100000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAAEAAAAIABBgBgAAAAAQMIACgAAAAD AgYAKAAAAAMECAAoAAAAAwIGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBgBgAAAAAwEGAGAAAAACAgYAYAAA AAICBwBgAAAAAgEGAGAAAAACAgsAAQABAiACAygCAgQgBAVoDAUGaAwGB2gM BwhoDAgJaAwJCgAKCwALDAAMDQANDgAJBGgMDgoAQgIAAAAGBAkIBwYFBQsK Dg0MFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:58:39Z</structure-indexed-at> </compound>