1.0 2020-03-10 17:00:33 UTC 2020-04-22 18:55:48 UTC BMDB0096061 BMDB96061 Ne,Ne dimethyllysine epsilon N-Dimethyllysine N epsilon,N epsilon Dimethyllysine N epsilon,N epsilon-Dimethyl-lysine N(6),N(6)-Dimethyllysine N,N-Dimethyl lysine 2-Amino-6-(dimethylamino)hexanoate C8H18N2O2 174.2407 174.13682783 2-amino-6-(dimethylamino)hexanoic acid N-dimethyl-lysine CN(C)CCCCC(N)C(O)=O InChI=1S/C8H18N2O2/c1-10(2)6-4-3-5-7(9)8(11)12/h7H,3-6,9H2,1-2H3,(H,11,12) XXEWFEBMSGLYBY-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 Amino fatty acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Medium-chain fatty acids Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Trialkylamines Aliphatic acyclic compound Alpha-amino acid Amine Amino acid Amino fatty acid Carbonyl group Carboxylic acid Fatty acid Fatty acyl Hydrocarbon derivative Medium-chain fatty acid Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Tertiary aliphatic amine Tertiary amine Aliphatic acyclic compounds logp -1.60 ALOGPS logs -0.01 ALOGPS logp -2.7 ChemAxon pka_strongest_acidic 2.84 ChemAxon pka_strongest_basic 9.98 ChemAxon iupac 2-amino-6-(dimethylamino)hexanoic acid ChemAxon average_mass 174.2407 ChemAxon mono_mass 174.13682783 ChemAxon smiles CN(C)CCCCC(N)C(O)=O ChemAxon formula C8H18N2O2 ChemAxon inchi InChI=1S/C8H18N2O2/c1-10(2)6-4-3-5-7(9)8(11)12/h7H,3-6,9H2,1-2H3,(H,11,12) ChemAxon inchikey XXEWFEBMSGLYBY-UHFFFAOYSA-N ChemAxon polar_surface_area 66.56 ChemAxon refractivity 47.88 ChemAxon polarizability 20.02 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 1 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 23736 Specdb::CMs 40103 Specdb::CMs 170534 Specdb::MsMs 8186 Specdb::MsMs 8187 Specdb::MsMs 8188 Specdb::MsMs 14858 Specdb::MsMs 14859 Specdb::MsMs 14860 Specdb::MsMs 3051209 Specdb::MsMs 3051210 Specdb::MsMs 3051211 Specdb::MsMs 3119197 Specdb::MsMs 3119198 Specdb::MsMs 3119199 Specdb::MsIr 2889 Specdb::MsIr 2890 Specdb::MsIr 2891 Specdb::NmrOneD 99478 Specdb::NmrOneD 99479 Specdb::NmrOneD 99480 Specdb::NmrOneD 99481 Specdb::NmrOneD 99482 Specdb::NmrOneD 99483 Specdb::NmrOneD 99484 Specdb::NmrOneD 99485 Specdb::NmrOneD 99486 Specdb::NmrOneD 99487 Specdb::NmrOneD 99488 Specdb::NmrOneD 99489 Specdb::NmrOneD 99490 Specdb::NmrOneD 99491 Specdb::NmrOneD 99492 Specdb::NmrOneD 99493 Specdb::NmrOneD 99494 Specdb::NmrOneD 99495 Specdb::NmrOneD 99496 Specdb::NmrOneD 99497 FDB029364 C05545 3676766 4478779 172425