1.0 2016-09-30 22:51:38 UTC 2020-04-22 15:09:53 UTC BMDB0002141 BMDB02141 N-Methyl-a-aminoisobutyric acid 2-(Methylamino)isobutyric acid 2-(Methylamino)isobutyrate N-Methyl-a-aminoisobutyrate N-Methylaminoisobutyric acid N-Methylaminoisobutyrate N-Methyl-alpha-aminoisobutyrate N-Methyl-alpha-aminoisobutyric acid N-(methylamino)Isobutyric acid AMAIB N-Methyl alpha-aminoisobutyric acid alpha-Methylaminoisobutyrate alpha-(methylamino)Isobutyrate a-(Methylamino)isobutyrate a-(Methylamino)isobutyric acid Α-(methylamino)isobutyrate Α-(methylamino)isobutyric acid N-Methyl-a-aminoisobutyric acid N-Methyl-α-aminoisobutyrate N-Methyl-α-aminoisobutyric acid C5H11NO2 117.1463 117.078978601 2-methyl-2-(methylamino)propanoic acid 2-(methylamino)isobutyric acid 2566-34-9 CNC(C)(C)C(O)=O InChI=1S/C5H11NO2/c1-5(2,6-3)4(7)8/h6H,1-3H3,(H,7,8) DLAMVQGYEVKIRE-UHFFFAOYSA-N belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Alpha amino acids Amino acids Carbonyl compounds Carboxylic acids Dialkylamines Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Aliphatic acyclic compound Alpha-amino acid Amine Amino acid Carbonyl group Carboxylic acid Hydrocarbon derivative Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary aliphatic amine Secondary amine Aliphatic acyclic compounds Solid melting_point 300 °C logp -2.08 ALOGPS logs 0.06 ALOGPS logp -2.2 ChemAxon pka_strongest_acidic 2.23 ChemAxon pka_strongest_basic 10.52 ChemAxon iupac 2-methyl-2-(methylamino)propanoic acid ChemAxon average_mass 117.1463 ChemAxon mono_mass 117.078978601 ChemAxon smiles CNC(C)(C)C(O)=O ChemAxon formula C5H11NO2 ChemAxon inchi InChI=1S/C5H11NO2/c1-5(2,6-3)4(7)8/h6H,1-3H3,(H,7,8) ChemAxon inchikey DLAMVQGYEVKIRE-UHFFFAOYSA-N ChemAxon polar_surface_area 49.33 ChemAxon refractivity 29.99 ChemAxon polarizability 12.27 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 7976 Specdb::CMs 38288 Specdb::CMs 149936 Specdb::NmrTwoD 1798 Specdb::MsMs 2016 Specdb::MsMs 2017 Specdb::MsMs 2018 Specdb::MsMs 257022 Specdb::MsMs 257023 Specdb::MsMs 257024 Specdb::MsMs 276963 Specdb::MsMs 276964 Specdb::MsMs 276965 Specdb::MsMs 2341941 Specdb::MsMs 2341942 Specdb::MsMs 2341943 Specdb::MsMs 2593411 Specdb::MsMs 2593412 Specdb::MsMs 2593413 Specdb::MsIr 1643 Specdb::MsIr 1644 Specdb::MsIr 1645 Specdb::NmrOneD 1858 Specdb::NmrOneD 148980 Specdb::NmrOneD 148981 Specdb::NmrOneD 148982 Specdb::NmrOneD 148983 Specdb::NmrOneD 148984 Specdb::NmrOneD 148985 Specdb::NmrOneD 148986 Specdb::NmrOneD 148987 Specdb::NmrOneD 148988 Specdb::NmrOneD 148989 Specdb::NmrOneD 148990 Specdb::NmrOneD 148991 Specdb::NmrOneD 148992 Specdb::NmrOneD 148993 Specdb::NmrOneD 148994 Specdb::NmrOneD 148995 Specdb::NmrOneD 148996 Specdb::NmrOneD 148997 Specdb::NmrOneD 148998 Specdb::NmrOneD 148999 FDB022865 DB08832 68242 6951124 134261 6508