1.0 2026-09-22 07:29:50 UTC 2026-09-22 07:29:50 UTC FDB117896 2-AMINO-4-(3-INDOLYL)PYRIMIDINE 4-(1H-indol-3-yl)pyrimidin-2-amine C12H10N4 210.24 210.090546338 4-(1H-indol-3-yl)pyrimidin-2-amine 4-(1H-indol-3-yl)pyrimidin-2-amine NC1=NC=CC(=N1)C1=CNC2=CC=CC=C12 InChI=1S/C12H10N4/c13-12-14-6-5-11(16-12)9-7-15-10-4-2-1-3-8(9)10/h1-7,15H,(H2,13,14,16) QNMZWFNNJMGJPU-UHFFFAOYSA-N belongs to the class of organic compounds known as indoles. Indoles are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole. Indoles Organic compounds Organoheterocyclic compounds Indoles and derivatives Indoles Aromatic heteropolycyclic compounds Aminopyrimidines and derivatives Azacyclic compounds Benzenoids Heteroaromatic compounds Hydrocarbon derivatives Organopnictogen compounds Primary amines Substituted pyrroles Amine Aminopyrimidine Aromatic heteropolycyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Indole Organic nitrogen compound Organonitrogen compound Organopnictogen compound Primary amine Pyrimidine Pyrrole Substituted pyrrole logp 2.14 ALOGPS logs -2.66 ALOGPS solubility 4.60e-01 g/l ALOGPS logp 2.03 ChemAxon pka_strongest_acidic 14.75 ChemAxon pka_strongest_basic 3.75 ChemAxon iupac 4-(1H-indol-3-yl)pyrimidin-2-amine ChemAxon average_mass 210.24 ChemAxon mono_mass 210.090546338 ChemAxon smiles NC1=NC=CC(=N1)C1=CNC2=CC=CC=C12 ChemAxon formula C12H10N4 ChemAxon inchi InChI=1S/C12H10N4/c13-12-14-6-5-11(16-12)9-7-15-10-4-2-1-3-8(9)10/h1-7,15H,(H2,13,14,16) ChemAxon inchikey QNMZWFNNJMGJPU-UHFFFAOYSA-N ChemAxon polar_surface_area 67.59 ChemAxon refractivity 63.22 ChemAxon polarizability 22.25 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon