methyl 1-[3-(pyrimidin-2-ylamino)propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(pyrimidin-2-ylamino)propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[3-(pyrimidin-2-ylamino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(2-pyrimidinylamino)propyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(pyrimidin-2-ylamino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(2-pyrimidylamino)propanoyl]isonipecotic acid methyl ester Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CCNC2=NC=CC=N2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CCNC2=NC=CC=N2

InChI

InChI=1S/C14H20N4O3/c1-21-13(20)11-4-9-18(10-5-11)12(19)3-8-17-14-15-6-2-7-16-14/h2,6-7,11H,3-5,8-10H2,1H3,(H,15,16,17)