1-[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]piperidine-4-carboxylic acid Openeye Name: 1-[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-[5-amino-6-[(6-methyl-2-pyridinyl)amino]-4-pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[5-amino-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]piperidine-4-carboxylic acid Traditional Name: 1-[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]isonipecotic acid Formula: C16H20N6O2 MolecularWeight: 328.369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=NC=NC(=C2N)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=NC(=CC=C1)NC2=NC=NC(=C2N)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H20N6O2/c1-10-3-2-4-12(20-10)21-14-13(17)15(19-9-18-14)22-7-5-11(6-8-22)16(23)24/h2-4,9,11H,5-8,17H2,1H3,(H,23,24)(H,18,19,20,21)