2-Amino-5-pyrimidinecarboxylic acid

C₅H₅N₃O₂CAS 3167-50-8139.11 g/mol

Open in Covalent MOL file

Carboxylic acid

Properties

Molecular formula: C₅H₅N₃O₂
Molar mass: 139.11 g/mol
Exact mass: 139.0382 Da
Melting point: above 300 °C
logP: -0.41Crippen estimate
Polar surface area: 89.8 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 1

Identifiers

CAS number

3167-50-8

SMILES

N=c1ncc(C(=O)O)c[nH]1

InChIKey

CBRLWSXYXSFYSP-UHFFFAOYSA-N

InChI

InChI=1S/C5H5N3O2/c6-5-7-1-3(2-8-5)4(9)10/h1-2H,(H,9,10)(H2,6,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

5-Pyrimidinecarboxylic acid, 2-amino-
2-Amino-5-carboxypyrimidine

Work with 2-Amino-5-pyrimidinecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Aminonicotinic acid3167-49-550 % similar Pyrazole-4-carboxylic acid37718-11-950 % similar 5-Pyrimidinecarboxylic acid4595-61-347 % similar [2,2′-Bipyridine]-5,5′-dicarboxylic acid1802-30-846 % similar 1H-Pyrrolo[2,3-B]pyridine-5-carboxylic acid754214-42-145 % similar 2-Amino-5-pyrimidinemethanol120747-85-543 % similar (2-Aminopyrimidin-5-yl)boronic acid936250-22-543 % similar 5-Iodo-2-pyrimidinamine1445-39-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Nitro-3-pyridinamine13269-19-7 6-Nitro-2-pyridinamine14916-63-3 4-Amino-3-nitropyridine1681-37-4 2-Amino-3-nitropyridine4214-75-9 2-Amino-5-nitropyridine4214-76-0 3-Amino-2-pyrazinecarboxylic acid5424-01-1

Elsewhere

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