chempirical

1-Aminohydantoin

C3H5N3O2CAS 6301-02-6115.09 g/mol

Open in Covalent MOL file
H2NNONHO
Primary amine

Properties

Molecular formula
C3H5N3O2
Molar mass
115.09 g/mol
Exact mass
115.0382 Da
Melting point
195–196 °C
logP
-0.75Crippen estimate
Polar surface area
78.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
6301-02-6
SMILES
NN1CC(O)=NC1=O
InChIKey
KVYKDNGUEZRPGJ-UHFFFAOYSA-N
InChI
InChI=1S/C3H5N3O2/c4-6-1-2(7)5-3(6)8/h1,4H2,(H,5,7,8)

Weigh it out

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

Names and synonyms

4 names
  • 2,4-Imidazolidinedione, 1-amino-
  • Hydantoin, 1-amino-
  • 1-Amino-2,4-imidazolidinedione
  • NSC 44144

Work with 1-Aminohydantoin

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

1-Aminohydantoin hydrochloride2827-56-788 % similar 1-Methylhydantoin616-04-653 % similar 1-(Phenylmethyl)-2,4-imidazolidinedione6777-05-542 % similar 1-Methyl-2,4,6(1H,3H,5H)-pyrimidinetrione2565-47-140 % similar Barbituric acid67-52-738 % similar Creatinine hydrochloride19230-81-032 % similar 2-Methyl-4,6-pyrimidinedione40497-30-131 % similar Nitrilotriacetic acid139-13-931 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook