chempirical

1-Acetamidoadamantane

C12H19NOCAS 880-52-4193.29 g/mol

Open in Covalent MOL file
OHN

Properties

Molecular formula
C12H19NO
Molar mass
193.29 g/mol
Exact mass
193.1467 Da
Melting point
148 °C
logP
2.93Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
880-52-4
SMILES
CC(O)=NC12CC3CC(CC(C3)C1)C2
InChIKey
BCVXYGJCDZPKGV-UHFFFAOYSA-N
InChI
InChI=1S/C12H19NO/c1-8(14)13-12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3,(H,13,14)

Weigh it out

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

Names and synonyms

9 names
  • Acetamide, N-tricyclo[3.3.1.13,7]dec-1-yl-
  • Acetamide, N-1-adamantyl-
  • N-Tricyclo[3.3.1.13,7]dec-1-ylacetamide
  • N-1-Adamantylacetamide
  • N-Adamantylacetamide
  • N-(Tricyclo[3.3.1.13,7]dec-1-yl)acetamide
  • NSC 527917
  • N-Acetyl amantadine
  • N-(Adamantan-1-yl)acetamide

Work with 1-Acetamidoadamantane

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-Acetamido-3,5-dimethyladamantane19982-07-159 % similar N,N′-Diacetylethylenediamine871-78-336 % similar 1,2-Diacetylhydrazine3148-73-035 % similar 1-Acetyladamantane1660-04-434 % similar Adamantyl isothiocyanate4411-26-134 % similar Tricyclo[3.3.1.13,7]decane-1-carboxamide5511-18-234 % similar 4-Acetamido-tempo14691-89-533 % similar Ethylacetamide625-50-333 % similar

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

Same formula

2-Ethylamino-1-(4′-methoxyphenyl)propane14367-46-5 2-(Butylphenylamino)ethanol3046-94-4 4-(Hexyloxy)aniline39905-57-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook