Methyl (1S,2S,3S,4R)-3-[(1S)-1-amino-2-ethylbutyl]-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxycyclopentanecarboxylate

C18H34N2O5CAS 316173-29-2358.48 g/mol

Open in Covalent MOL file
H2NOHOOHNOO
AlcoholEsterPrimary amine

Properties

Molecular formula
C18H34N2O5
Molar mass
358.48 g/mol
Exact mass
358.2468 Da
logP
2.02Crippen estimate
Polar surface area
114.4 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
6
Stereocentres
S, S, S, S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
316173-29-2
SMILES
CCC(CC)[C@H](N)[C@@H]1[C@H](O)[C@@H](C(=O)OC)C[C@H]1N=C(O)OC(C)(C)C
InChIKey
SECXLAHYOAZIGA-VYDRJRHOSA-N
InChI
InChI=1S/C18H34N2O5/c1-7-10(8-2)14(19)13-12(20-17(23)25-18(3,4)5)9-11(15(13)21)16(22)24-6/h10-15,21H,7-9,19H2,1-6H3,(H,20,23)/t11-,12+,13+,14-,15+/m0/s1

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Names and synonyms

2 names
  • Cyclopentanecarboxylic acid, 3-[(1S)-1-amino-2-ethylbutyl]-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-, methyl ester, (1S,2S,3S,4R)-
  • (1S,2S,3S,4R)-Methyl 3-((S)-1-amino-2-ethylbutyl)-4-(tert-butoxycarbonylamino)-2-hydroxycyclopentanecarboxylate

Work with Methyl (1S,2S,3S,4R)-3-[(1S)-1-amino-2-ethylbutyl]-4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxycyclopentanecarboxylate

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Similar compounds

(2S)-2-[[(1,1-Dimethylethoxy)carbonyl]amino]butanoic acid34306-42-842 % similar Dimethyl N-(tert-Butoxycarbonyl)-L-glutamate59279-60-642 % similar Methyl (αR,βS)-β-[[(1,1-dimethylethoxy)carbonyl]amino]-α-hydroxybenzenepropanoate124605-42-140 % similar tert-Butoxycarbonyl-L-isoleucine13139-16-740 % similar Nε-tert-Butoxycarbonyllysine methyl ester hydrochloride2389-48-239 % similar Boc-ile-OSu3392-08-337 % similar 1,1-Dimethylethyl N-[(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate365998-36-337 % similar Boc-L-leucine13139-15-637 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

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