tert-butyl 1-methyl-4-[[3-(2-methylbutan-2-ylamino)pyridin-2-yl]amino]piperidine-2-carboxylate

Systemtic Name: tert-butyl 1-methyl-4-[[3-(2-methylbutan-2-ylamino)pyridin-2-yl]amino]piperidine-2-carboxylate Openeye Name: tert-butyl 4-[[3-(1,1-dimethylpropylamino)-2-pyridyl]amino]-1-methyl-piperidine-2-carboxylate CAS Name: 1-methyl-4-[[3-(2-methylbutan-2-ylamino)-2-pyridinyl]amino]-2-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-methyl-4-[[3-(2-methylbutan-2-ylamino)pyridin-2-yl]amino]piperidine-2-carboxylate Traditional Name: 4-[[3-(tert-amylamino)-2-pyridyl]amino]-1-methyl-pipecolinic acid tert-butyl ester Formula: C21H36N4O2 MolecularWeight: 376.53614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(N=CC=C1)NC2CCN(C(C2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCC(C)(C)NC1=C(N=CC=C1)NC2CCN(C(C2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H36N4O2/c1-8-21(5,6)24-16-10-9-12-22-18(16)23-15-11-13-25(7)17(14-15)19(26)27-20(2,3)4/h9-10,12,15,17,24H,8,11,13-14H2,1-7H3,(H,22,23)