chempirical

Lipoamide

C8H15NOS2CAS 3206-73-3205.33 g/mol

Open in Covalent MOL file
H2NOSS
Disulfide

Properties

Molecular formula
C8H15NOS2
Molar mass
205.33 g/mol
Exact mass
205.0595 Da
Melting point
124–126 °C
logP
3.24Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
5

Identifiers

CAS number
3206-73-3
SMILES
N=C(O)CCCCC1CCSS1
InChIKey
FCCDDURTIIUXBY-UHFFFAOYSA-N
InChI
InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)

Weigh it out

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

Names and synonyms

26 names · show all
  • 1,2-Dithiolane-3-pentanamide
  • α-Lipamide
  • 1,2-Dithiolane-3-valeramide
  • α-Lipoamide
  • Thioctamide
  • Lipamide
  • 5-(1,2-Dithiolan-3-yl)valeramide
  • Lipoacin
  • Lipoamid
  • Lipoicin
  • Pathoclon
  • Thioami
  • Thioctamid
  • Thiotomin
  • Ticolin
  • Vitamin N
  • Thioctic acid amide
  • Thioctic amide
  • 5-(1,2-Dithiolan-3-yl)pentanamide
  • DL-Lipoamide
  • (±)-1,2-Dithiolane-3-valeramide
  • (±)-1,2-Dithiolane-3-pentanamide
  • (±)-Thioctic acid amide
  • DL-6,8-Thioctamide
  • NSC 90787
  • DL-α-Lipoic acid amide

Work with Lipoamide

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

Lipoic acid1077-28-762 % similar α-Lipoic acid1200-22-262 % similar (±)-Lipoic acid62-46-462 % similar Adipamide628-94-452 % similar Hexanamide628-02-444 % similar Dodecanamide1120-16-742 % similar Stearamide124-26-542 % similar Behenamide3061-75-442 % similar

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

Same formula

Lipoamide940-69-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook