Molecule ID: 84894

IUPAC Name: ethyl 2-amino-6-oxo-1H-pyrimidine-5-carboxylate

Description: The molecule is an aminopyrimidine that is 2-amino-4-hydroxypyrimidine in which the hydrogen at position 5 is substituted by an ethoxycarbonyl group. It is a pyrimidinecarboxylate ester, an aminopyrimidine, a hydroxypyrimidine and an ethyl ester.

SMILES: CCOC(=O)c1c[nH]c(=N)nc1O

SELFIES: [C][C][O][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=N][N][=C][Ring1][#Branch1][O]

InChI: InChI=1S/C7H9N3O3/c1-2-13-6(12)4-3-9-7(8)10-5(4)11/h3H,2H2,1H3,(H3,8,9,10,11)

Molecular Properties:
- Polar Surface Area: 93.8 Ų
- LogP: -0.9