chempirical

N2-[(1,1-Dimethylethoxy)carbonyl]-N6-formyl-L-lysine

C12H22N2O5CAS 2483-47-8274.32 g/mol

Open in Covalent MOL file
OONHNHOOHO
Carboxylic acid

Properties

Molecular formula
C12H22N2O5
Molar mass
274.32 g/mol
Exact mass
274.1529 Da
logP
1.93Crippen estimate
Polar surface area
111.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
7
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
2483-47-8
SMILES
CC(C)(C)OC(O)=N[C@@H](CCCCN=CO)C(=O)O
InChIKey
QYCPNUMTVZBTMM-VIFPVBQESA-N
InChI
InChI=1S/C12H22N2O5/c1-12(2,3)19-11(18)14-9(10(16)17)6-4-5-7-13-8-15/h8-9H,4-7H2,1-3H3,(H,13,15)(H,14,18)(H,16,17)/t9-/m0/s1

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

Names and synonyms

4 names
  • L-Lysine, N2-[(1,1-dimethylethoxy)carbonyl]-N6-formyl-
  • Lysine, N2-carboxy-N6-formyl-, N2-tert-butyl ester, L-
  • NSC 334077
  • (S)-2-((tert-Butoxycarbonyl)amino)-6-formamidohexanoic acid

Work with N2-[(1,1-Dimethylethoxy)carbonyl]-N6-formyl-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-lysine13734-28-667 % similar N-[(1,1-Dimethylethoxy)carbonyl]-D-norleucine55674-63-066 % similar N-tert-Butoxycarbonyl-L-norleucine6404-28-066 % similar L-Lysine, N2,N6-bis[(1,1-dimethylethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)15098-69-864 % similar N2-[(1,1-Dimethylethoxy)carbonyl]-N6-(2,2,2-trifluoroacetyl)-L-lysine16965-06-364 % similar N-[(1,1-Dimethylethoxy)carbonyl]-L-homoserine41088-86-262 % similar N2-Acetyl-N6-[(1,1-dimethylethoxy)carbonyl]-L-lysine23500-04-162 % similar 5-(1,1-Dimethylethyl) hydrogen N-[(1,1-dimethylethoxy)carbonyl]-L-glutamate13726-84-660 % similar

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

Elsewhere

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