1.02010-04-08 22:10:12 UTC2020-09-17 15:30:49 UTCFDB0124952-Methyl-1-propylamine2-Methyl-1-propylamine, also known as isobutylamine or valamine, belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing a primary aliphatic amine group. 2-Methyl-1-propylamine is a strong basic compound. 2-Methyl-1-propylamine is a clear, colorless liquid with a cheesy and fishy taste. 2-Methyl-1-propylamine exists in all living organisms, from bacteria to humans. 2-Methyl-1-propylamine has been detected in black elderberries, common grapes, and French plantains. This could make 2-methyl-1-propylamine a potential biomarker for the consumption of these foods.1-Amino-2-methylpropane1-Propanamine, 2-methyl-2-Methyl-1-Aminopropane2-Methyl-1-propanamine2-Methyl-1-propanamine, 9CI2-methylpropan-1-amine2-Methylpropanamine2-Methylpropylamine3-Methyl-2-propylamineI-butylamineIso-butylamineIso-C4H9NH2IsobutylamineIsobutylamine, 8CIMonoisobutylamineValamineValamine?C4H11N73.136873.0891493572-methylpropan-1-amineisobutylamine78-81-9CC(C)CNInChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3KDSNLYIMUZNERS-UHFFFAOYSA-N belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.MonoalkylaminesOrganic compoundsOrganic nitrogen compoundsOrganonitrogen compoundsAminesAliphatic acyclic compoundsHydrocarbon derivativesOrganopnictogen compoundsAliphatic acyclic compoundHydrocarbon derivativeOrganopnictogen compoundPrimary aliphatic aminea small moleculealkylamineslogp0.54logs0.07solubility8.55e+01 g/lmelting_pointFp -84.6°logp0.62pka_strongest_basic10.24iupac2-methylpropan-1-amineaverage_mass73.1368mono_mass73.089149357smilesCC(C)CNformulaC4H11NinchiInChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3inchikeyKDSNLYIMUZNERS-UHFFFAOYSA-Npolar_surface_area26.02refractivity23.66polarizability9.51rotatable_bond_count1acceptor_count1donor_count1physiological_charge1formal_charge0Specdb::MsIr6467Specdb::MsIr6468Specdb::MsIr6469Specdb::CMs15385Specdb::CMs26798Specdb::CMs27913Specdb::CMs29404Specdb::CMs30578Specdb::CMs101559Specdb::CMs101560Specdb::CMs101561Specdb::CMs101562Specdb::CMs151148Specdb::NmrOneD287195Specdb::NmrOneD287196Specdb::NmrOneD287197Specdb::NmrOneD287198Specdb::NmrOneD287199Specdb::NmrOneD287200Specdb::NmrOneD287201Specdb::NmrOneD287202Specdb::NmrOneD287203Specdb::NmrOneD287204Specdb::NmrOneD287205Specdb::NmrOneD287206Specdb::NmrOneD287207Specdb::NmrOneD287208Specdb::NmrOneD287209Specdb::NmrOneD287210Specdb::NmrOneD287211Specdb::NmrOneD287212Specdb::NmrOneD287213Specdb::NmrOneD287214Specdb::MsMs27191Specdb::MsMs27192Specdb::MsMs27193Specdb::MsMs33749Specdb::MsMs33750Specdb::MsMs33751Specdb::MsMs1470843Specdb::MsMs1470867Specdb::MsMs2232571Specdb::MsMs2722584Specdb::MsMs2722585Specdb::MsMs2722586Specdb::MsMs2960103Specdb::MsMs2960104Specdb::MsMs2960105HMDB3419815997IBN#<Reference:0x00005556745b20f0>#<Reference:0x00005556745b1ee8>#<Reference:0x00005556745b1d30>#<Reference:0x00005556745b1b78>#<Reference:0x00005556745b1998>#<Reference:0x00005556745b16c8>#<Reference:0x00005556745b1498>#<Reference:0x00005556745b12e0>#<Reference:0x00005556745b1128>#<Reference:0x00005556745b0f70>#<Reference:0x00005556745b0db8>#<Reference:0x00005556745b0bd8>#<Reference:0x00005556745b09a8>#<Reference:0x00005556745b07a0>#<Reference:0x00005556745b05c0>#<Reference:0x00005556745b03e0>#<Reference:0x00005556745b0228>#<Reference:0x00005556745b0070>BeerType 2specific0.1120.1120.112mg/100 gBlack elderberryType 1specificSambucus nigra4202Common grapeType 1specificVitis vinifera29760French plantainType 1specificMusa X paradisiaca89151Red wineType 20.070.070.07mg/100 gWhite wineType 20.0350.050.02mg/100 gcheesyfishy