chempirical

2-Amidinopyrimidine hydrochloride

C5H7ClN4CAS 138588-40-6158.59 g/mol

Open in Covalent MOL file
HClHNH2NNN
Amidine

Properties

Molecular formula
C5H7ClN4
Molar mass
158.59 g/mol
Exact mass
158.0359 Da
logP
0.18Crippen estimate
Polar surface area
75.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
138588-40-6
SMILES
Cl.N=C(N)c1ncccn1
InChIKey
LZIYBABLVXXFGZ-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N4.ClH/c6-4(7)5-8-2-1-3-9-5;/h1-3H,(H3,6,7);1H

Weigh it out

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

Names and synonyms

3 names
  • 2-Pyrimidinecarboximidamide, hydrochloride (1:1)
  • 2-Pyrimidinecarboximidamide, monohydrochloride
  • 2-Pyrimidinecarboximidamide, hydrochloride

Work with 2-Amidinopyrimidine hydrochloride

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

Thiazole-2-carboxamidine hydrochloride247037-82-748 % similar 3-Guanylpyridine hydrochloride7356-60-747 % similar Benzamidine hydrochloride1670-14-047 % similar Benzenecarboximidamide, hydrochloride, hydrate (1:1:?)206752-36-542 % similar Biphenyl-4-carboxamidine hydrochloride111082-23-641 % similar p-Aminobenzamidine dihydrochloride2498-50-239 % similar 2-Aminomethylpyrimidine hydrochloride372118-67-739 % similar 4-Chlorobenzamidine hydrochloride14401-51-538 % similar

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

Same formula

Pyrazine-2-carboximidamide monohydrochloride138588-41-7

Elsewhere

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