1.0 2010-04-08 22:09:16 UTC 2019-11-26 03:04:02 UTC FDB010723 N-Methyl-1H-indole-3-propanamide Production by Omphalotus olearius (common chanterelle). N-Methyl-1H-indole-3-propanamide is found in mushrooms. 3-(3-Indolyl)-N-methylpropanamide N-Methyl-1H-indole-3-propanamide C12H14N2O 202.2524 202.11061308 3-(1H-indol-3-yl)-N-methylpropanamide 3-(1H-indol-3-yl)-N-methylpropanamide 69397-85-9 CNC(=O)CCC1=CNC2=C1C=CC=C2 InChI=1S/C12H14N2O/c1-13-12(15)7-6-9-8-14-11-5-3-2-4-10(9)11/h2-5,8,14H,6-7H2,1H3,(H,13,15) YRFPBFOOZPGAAH-UHFFFAOYSA-N belongs to the class of organic compounds known as tryptamines and derivatives. Tryptamines and derivatives are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine. Tryptamines and derivatives Organic compounds Organoheterocyclic compounds Indoles and derivatives Tryptamines and derivatives Aromatic heteropolycyclic compounds 3-alkylindoles Azacyclic compounds Benzenoids Carbonyl compounds Fatty amides Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Substituted pyrroles 3-alkylindole Aromatic heteropolycyclic compound Azacycle Benzenoid Carbonyl group Carboxamide group Carboxylic acid derivative Fatty acyl Fatty amide Heteroaromatic compound Hydrocarbon derivative Indole Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Pyrrole Secondary carboxylic acid amide Substituted pyrrole Triptan logp 1.77 ALOGPS logs -2.76 ALOGPS solubility 3.50e-01 g/l ALOGPS melting_point Mp 97.5-99° (synthetic) logp 1.57 ChemAxon pka_strongest_acidic 15.93 ChemAxon pka_strongest_basic -0.98 ChemAxon iupac 3-(1H-indol-3-yl)-N-methylpropanamide ChemAxon average_mass 202.2524 ChemAxon mono_mass 202.11061308 ChemAxon smiles CNC(=O)CCC1=CNC2=C1C=CC=C2 ChemAxon formula C12H14N2O ChemAxon inchi InChI=1S/C12H14N2O/c1-13-12(15)7-6-9-8-14-11-5-3-2-4-10(9)11/h2-5,8,14H,6-7H2,1H3,(H,13,15) ChemAxon inchikey YRFPBFOOZPGAAH-UHFFFAOYSA-N ChemAxon polar_surface_area 44.89 ChemAxon refractivity 59.77 ChemAxon polarizability 22.45 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11687 Specdb::CMs 170878 Specdb::MsIr 5727 Specdb::MsIr 5728 Specdb::MsIr 5729 Specdb::MsMs 53352 Specdb::MsMs 53353 Specdb::MsMs 53354 Specdb::MsMs 171324 Specdb::MsMs 171325 Specdb::MsMs 171326 Specdb::MsMs 2831260 Specdb::MsMs 2831261 Specdb::MsMs 2831262 Specdb::MsMs 2847467 Specdb::MsMs 2847468 Specdb::MsMs 2847469 HMDB32756 #<Reference:0x000055ce32268490> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322