1.0 2016-05-22 03:42:06 UTC 2026-08-22 01:45:03 UTC Isopropamide SmallMolecule Isopropamide is an organic compound with the formula C23H33N2O and an average molecular weight of 353.52 g/mol. Isopropamide belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. This compound is found in or released from eight recorded sources. These include electrical and electronic equipment, specifically electrodes, conductive bodies characterized by the conductive materials, and electrically stimulated smoking devices. Within household cleaning and consumer products, it is associated with tobacco smoke filters, non-electric simulated smoking devices, and perfumes used within soaps and detergents. In the context of healthcare, pharmaceuticals, and veterinary products, it is found in antispasmodics in combination with psycholeptics and drugs for functional gastrointestinal disorders. The recorded exposure route for this substance is oral. Isopropamide acts on two recorded protein targets. It functions as an antagonist of the Muscarinic acetylcholine receptor M3 (CHRM3) and the Muscarinic acetylcholine receptor M4 (CHRM4). C23H33N2O 353.5209 353.259288688 (3-carbamoyl-3,3-diphenylpropyl)(methyl)bis(propan-2-yl)azanium isopropamide 7492-32-2 CC(C)[N+](C)(CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1)C(C)C InChI=1S/C23H32N2O/c1-18(2)25(5,19(3)4)17-16-23(22(24)26,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h6-15,18-19H,16-17H2,1-5H3,(H-,24,26)/p+1 JTPUMZTWMWIVPA-UHFFFAOYSA-O Organic compounds Benzenoids Benzene and substituted derivatives Diphenylmethanes Diphenylmethanes Aralkylamines Carboximidic acids Hydrocarbon derivatives Organic cations Organic salts Organooxygen compounds Organopnictogen compounds Tetraalkylammonium salts Amine Aralkylamine Aromatic homomonocyclic compound Carboximidic acid Carboximidic acid derivative Diphenylmethane Hydrocarbon derivative Organic cation Organic nitrogen compound Organic oxygen compound Organic salt Organonitrogen compound Organooxygen compound Organopnictogen compound Quaternary ammonium salt Tetraalkylammonium salt Aromatic homomonocyclic compounds diarylmethane Detected and Not Quantified Isopropamide Drug Metabolism Action Pathway SMP0143820 Isopropamide Predicted Metabolism Pathway SMP0174537 logp 0.14 logp 2.27 ALOGPS logs -6.96 ALOGPS solubility 4.24e-05 g/l ALOGPS logp 0.14 ChemAxon pka_strongest_acidic 16.31 ChemAxon pka_strongest_basic -3.3 ChemAxon iupac (3-carbamoyl-3,3-diphenylpropyl)(methyl)bis(propan-2-yl)azanium ChemAxon average_mass 353.5209 ChemAxon mono_mass 353.259288688 ChemAxon smiles CC(C)[N+](C)(CCC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1)C(C)C ChemAxon formula C23H33N2O ChemAxon inchi InChI=1S/C23H32N2O/c1-18(2)25(5,19(3)4)17-16-23(22(24)26,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h6-15,18-19H,16-17H2,1-5H3,(H-,24,26)/p+1 ChemAxon inchikey JTPUMZTWMWIVPA-UHFFFAOYSA-O ChemAxon polar_surface_area 43.09 ChemAxon refractivity 120.74 ChemAxon polarizability 41.28 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 1 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7275ae6fe8> DB01625 3775 3643 BE0000045 BE0000405