1.0 2026-09-23 06:18:56 UTC 2026-09-23 06:18:56 UTC FDB119911 Withasomnine 3-phenyl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole C12H12N2 184.242 184.100048394 3-phenyl-4H,5H,6H-pyrrolo[1,2-b]pyrazole withasomnine C1CN2N=CC(=C2C1)C1=CC=CC=C1 InChI=1S/C12H12N2/c1-2-5-10(6-3-1)11-9-13-14-8-4-7-12(11)14/h1-3,5-6,9H,4,7-8H2 FOJCJLSJZFQCID-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylpyrazoles. Phenylpyrazoles are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group. Phenylpyrazoles Organic compounds Organoheterocyclic compounds Azoles Pyrazoles Aromatic heteropolycyclic compounds Azacyclic compounds Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Pyrroles Pyrrolopyrazoles Aromatic heteropolycyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organonitrogen compound Organopnictogen compound Phenylpyrazole Pyrrole Pyrrolopyrazole pyrazoles ring assembly logp 2.38 ALOGPS logs -2.31 ALOGPS solubility 9.00e-01 g/l ALOGPS logp 2.3 ChemAxon pka_strongest_basic 2.51 ChemAxon iupac 3-phenyl-4H,5H,6H-pyrrolo[1,2-b]pyrazole ChemAxon average_mass 184.242 ChemAxon mono_mass 184.100048394 ChemAxon smiles C1CN2N=CC(=C2C1)C1=CC=CC=C1 ChemAxon formula C12H12N2 ChemAxon inchi InChI=1S/C12H12N2/c1-2-5-10(6-3-1)11-9-13-14-8-4-7-12(11)14/h1-3,5-6,9H,4,7-8H2 ChemAxon inchikey FOJCJLSJZFQCID-UHFFFAOYSA-N ChemAxon polar_surface_area 17.82 ChemAxon refractivity 68.04 ChemAxon polarizability 20.8 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon