chempirical

N-Acetyl-L-lysine

C8H16N2O3CAS 1946-82-3188.23 g/mol

Open in Covalent MOL file
ONHNH2OHO
Carboxylic acidPrimary amine

Properties

Molecular formula
C8H16N2O3
Molar mass
188.23 g/mol
Exact mass
188.1161 Da
Melting point
250 °C (decomposes)
logP
0.55Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
1946-82-3
SMILES
CC(O)=N[C@@H](CCCCN)C(=O)O
InChIKey
VEYYWZRYIYDQJM-ZETCQYMHSA-N
InChI
InChI=1S/C8H16N2O3/c1-6(11)10-7(8(12)13)4-2-3-5-9/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1

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

Names and synonyms

9 names
  • L-Lysine, N2-acetyl-
  • Lysine, N2-acetyl-, L-
  • N2-Acetyl-L-lysine
  • Nα-Acetyl-L-lysine
  • Nα-acetyllysine
  • 6-Amino-L-2-acetamidohexanoic acid
  • N2-Acetyllysine
  • (2S)-6-Amino-2-acetamidohexanoic acid
  • (2S)-2-Acetamido-6-aminohexanoic acid

Work with N-Acetyl-L-lysine

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

α-tert-Butoxycarbonyl-L-lysine13734-28-659 % similar N-Acetyl-L-glutamic acid1188-37-059 % similar N-Acetylglutamic acid5817-08-359 % similar 2-(Acetylamino)butanoic acid7211-57-658 % similar N-Acetyl-L-arginine155-84-058 % similar N-Acetylmethionine1115-47-557 % similar N-Acetyl-D-methionine1509-92-857 % similar N-Acetyl-L-methionine65-82-757 % similar

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

Same formula

[4-(2-Hydroxy-ethyl)-piperazin-1-yl]-acetic acid124335-65-5 Glycyl-L-isoleucine19461-38-2 L-Asparagine tert-butyl ester25456-86-4 Leucylglycine615-82-7 L-Leucylglycine686-50-0 Glycylleucine688-14-2 Acetyllysine692-04-6 Glycyl-L-leucine869-19-2

Elsewhere

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