chempirical

Amiloride

C6H8ClN7OCAS 2609-46-3229.63 g/mol

Open in Covalent MOL file
HNH2NNHONClNH2NH2N
Aryl halidePrimary amine

Properties

Molecular formula
C6H8ClN7O
Molar mass
229.63 g/mol
Exact mass
229.0479 Da
Melting point
241 °C
logP
-0.51Crippen estimate
Polar surface area
160.3 Ų
H-bond donors / acceptors
5 / 5
Rotatable bonds
1

Identifiers

CAS number
2609-46-3
SMILES
N=C(N)N=C(O)c1nc(Cl)c(N)nc1N
InChIKey
XSDQTOBWRPYKKA-UHFFFAOYSA-N
InChI
InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)

Weigh it out

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

Names and synonyms

12 names
  • 2-Pyrazinecarboxamide, 3,5-diamino-N-(aminoiminomethyl)-6-chloro-
  • Pyrazinecarboxamide, N-amidino-3,5-diamino-6-chloro-
  • Pyrazinecarboxamide, 3,5-diamino-N-(aminoiminomethyl)-6-chloro-
  • 3,5-Diamino-N-(aminoiminomethyl)-6-chloro-2-pyrazinecarboxamide
  • N-Amidino-3,5-diamino-6-chloropyrazinecarboxamide
  • MK 870
  • (3,5-Diamino-6-chloropyrazinoyl)guanidine
  • Guanamprazine
  • Amipramidin
  • Hydikal
  • 3,5-Diamino-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide
  • 3,5-Diamino-N-carbamimidoyl-6-chloropyrazine-2-carboxamide

Work with Amiloride

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

Amiloride hydrochloride2016-88-891 % similar N-Amidino-3,5-diamino-6-chloropyrazinamide hydrochloride dihydrate17440-83-484 % similar Methyl 3,5-diamino-6-chloropyrazine-2-carboxylate1458-01-139 % similar N-(Aminoiminomethyl)acetamide5699-40-133 % similar Picloram1918-02-133 % similar Guanfacine hydrochloride29110-48-331 % similar Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate1458-18-030 % similar

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

Elsewhere

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