4-[4-(3,5-dimethylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-[4-(3,5-dimethylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine Openeye Name: 4-[4-(3,5-dimethyl-1-piperidyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine CAS Name: 4-[4-(3,5-dimethyl-1-piperidinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-pyrimidinamine IUPAC Name: 4-[4-(3,5-dimethylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine Traditional Name: [4-[4-(3,5-dimethylpiperidino)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-yl]amine Formula: C18H22N6 MolecularWeight: 322.40748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C3C(=CNC3=NC=C2)C4=NC(=NC=C4)N)C

Isomeric SMILES

CC1CC(CN(C1)C2=C3C(=CNC3=NC=C2)C4=NC(=NC=C4)N)C

InChI

InChI=1S/C18H22N6/c1-11-7-12(2)10-24(9-11)15-4-6-20-17-16(15)13(8-22-17)14-3-5-21-18(19)23-14/h3-6,8,11-12H,7,9-10H2,1-2H3,(H,20,22)(H2,19,21,23)