1.0 2010-04-08 22:10:15 UTC 2019-11-26 03:07:10 UTC FDB012595 N-Acetylhistamine Isolated from leaves of Spinacia oleracea (spinach). N-Acetylhistamine is found in green vegetables and spinach. 2afw 4-(2-acetamidoethyl)imidazole 4-(2-acetylaminoethyl)imidazole 4-(b-Acetylaminoethyl)imidazole 4-(beta-Acetylaminoethyl)imidazole 4-(β-acetylaminoethyl)imidazole a-N-Acetylhistamine Acetamide, {n-[2-(1H-imidazol-4-yl)ethyl]-} Acetamide, N-(2-(1H-imidazol-4-yl)ethyl)- (9CI) Acetamide, N-(2-imidazol-4-ylethyl)- Acetamide, N-(2-imidazol-4-ylethyl)- (8CI) Acetamide, N-[2-(1H-imidazol-4-yl)ethyl]- Acetylhistamine AHN alpha-N-Acetylhistamine Imidazole C-4(5) deriv. 1 N-.omega.-acetylhistamine N-(2-(1H-Imidazol-4-yl)ethyl)acetamide N-(2-(1H-Imidazol-4-yl)ethyl)acetamide (acd/name 4.0) N-(2-(Imidazol-4-yl)ethyl)acetamide N-(2-Imidazol-4-ylethyl)-acetamide N-[2-(1H-Imidazol-4-yl)ethyl]-acetamide N-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDE N-[2-(3H-imidazol-4-yl)ethyl]acetamide N-Acetylhistamine N-Omega-acetyl-histamine N-omega-acetylhistamine N'-acetylhistamine Nalpha-acetylhistamine Nomega-acetylhistamine Omega-N-acetylhistamine α-N-acetylhistamine C14H22N6O2 306.3635 306.180423978 bis(N-[2-(1H-imidazol-5-yl)ethyl]ethanimidic acid) bis(acetylhistamine) 673-49-4 CC(=O)NCCC1=CN=CN1.CC(=O)NCCC1=CNC=N1 InChI=1S/2C7H11N3O/c2*1-6(11)9-3-2-7-4-8-5-10-7/h2*4-5H,2-3H2,1H3,(H,8,10)(H,9,11) YGZLECLYVAYZKA-UHFFFAOYSA-N belongs to the class of organic compounds known as n-acetyl-2-arylethylamines. N-acetyl-2-arylethylamines are compounds containing an acetamide group that is N-linked to an arylethylamine. N-acetyl-2-arylethylamines Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Carboxylic acid derivatives Azacyclic compounds Carbonyl compounds Heteroaromatic compounds Hydrocarbon derivatives Imidazoles Organic oxides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Aromatic heteromonocyclic compound Azacycle Azole Carbonyl group Heteroaromatic compound Hydrocarbon derivative Imidazole N-acetyl-2-arylethylamine Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary carboxylic acid amide Solid logp -0.13 ALOGPS logs -1.84 ALOGPS solubility 2.22e+00 g/l ALOGPS melting_point Mp 147-148° logp -1.4 ChemAxon pka_strongest_acidic 4.38 ChemAxon pka_strongest_basic 6.9 ChemAxon iupac bis(N-[2-(1H-imidazol-5-yl)ethyl]ethanimidic acid) ChemAxon average_mass 306.3635 ChemAxon mono_mass 306.180423978 ChemAxon smiles CC(=O)NCCC1=CN=CN1.CC(=O)NCCC1=CNC=N1 ChemAxon formula C14H22N6O2 ChemAxon inchi InChI=1S/2C7H11N3O/c2*1-6(11)9-3-2-7-4-8-5-10-7/h2*4-5H,2-3H2,1H3,(H,8,10)(H,9,11) ChemAxon inchikey YGZLECLYVAYZKA-UHFFFAOYSA-N ChemAxon polar_surface_area 61.27 ChemAxon refractivity 42.19 ChemAxon polarizability 16.25 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 72408 Specdb::MsMs 72409 Specdb::MsMs 72410 Specdb::MsMs 131334 Specdb::MsMs 131335 Specdb::MsMs 131336 HMDB13253 28483 AHN Green vegetables Unknown generic Spinach Type 1 specific Spinacia oleracea 3562