chempirical

5-Aminopyrazine-2-carboxylic acid methyl ester

C6H7N3O2CAS 13924-94-2153.14 g/mol

Open in Covalent MOL file
OONNNH2
EsterPrimary amine

Properties

Molecular formula
C6H7N3O2
Molar mass
153.14 g/mol
Exact mass
153.0538 Da
logP
-0.15Crippen estimate
Polar surface area
78.1 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
1

Identifiers

CAS number
13924-94-2
SMILES
COC(=O)C1=CN=C(C=N1)N
InChIKey
RPEZSZAVQOVHCZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H7N3O2/c1-11-6(10)4-2-9-5(7)3-8-4/h2-3H,1H3,(H2,7,9)

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Names and synonyms

1 names
  • Methyl 5-aminopyrazine-2-carboxylate

Work with 5-Aminopyrazine-2-carboxylic acid methyl ester

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

5-Aminopyrazine-2-carboxylic acid ethyl ester54013-06-864 % similar Methyl 2-pyrazinecarboxylate6164-79-054 % similar Methyl 5-fluoropyridine-2-carboxylate107504-07-450 % similar 5-Bromopyridine-2-carboxylic acid methyl ester29682-15-350 % similar Methyl 5-hydroxy-2-pyridinecarboxylate30766-12-250 % similar Methyl 3-isoquinolinecarboxylate27104-73-049 % similar Methyl 4-amino-5-nitro-2-pyridinecarboxylate850544-21-747 % similar Methyl 5-chloro-6-methylpyrazine-2-carboxylate77168-85-546 % similar

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

Same formula

(4-Nitrophenyl)hydrazine100-16-3 1-Hydroxy-1H-benzotriazole hydrate (1:?)123333-53-9 6-Hydrazinonicotinic acid133081-24-0 N4-Acetylcytosine14631-20-0 2-Amino-3-(methoxycarbonyl)pyrazine16298-03-6 6-Methyl-5-nitro-2-pyridinamine22280-62-2 (2-Nitrophenyl)hydrazine3034-19-3 3-Nitro-1,2-phenylenediamine3694-52-8

Elsewhere

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