chempirical

1-tert-Butoxycarbonylaminocyclopentanecarboxylic acid

C11H19NO4CAS 35264-09-6229.28 g/mol

Open in Covalent MOL file
OONHOHO
Carboxylic acid

Properties

Molecular formula
C11H19NO4
Molar mass
229.28 g/mol
Exact mass
229.1314 Da
logP
2.11Crippen estimate
Polar surface area
79.1 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

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

Identifiers

CAS number
35264-09-6
SMILES
CC(C)(C)OC(O)=NC1(C(=O)O)CCCC1
InChIKey
YBZCSKVLXBOFSL-UHFFFAOYSA-N
InChI
InChI=1S/C11H19NO4/c1-10(2,3)16-9(15)12-11(8(13)14)6-4-5-7-11/h4-7H2,1-3H3,(H,12,15)(H,13,14)

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Names and synonyms

8 names
  • Cyclopentanecarboxylic acid, 1-[[(1,1-dimethylethoxy)carbonyl]amino]-
  • 1-[[(1,1-Dimethylethoxy)carbonyl]amino]cyclopentanecarboxylic acid
  • 1-tert-Butoxycarbonylamino-1-cyclopentanecarboxylic acid
  • N-Boc-1-aminocyclopentane-1-carboxylic acid
  • 1-[(t-Butoxycarbonyl)amino]cyclopentanecarboxylic acid
  • 1-(N-(tert-Butoxycarbonyl)amino)cyclopentanecarboxylic acid
  • 1-((tert-Butoxycarbonyl)amino)cyclopentan-1-carboxylic acid
  • 1-(Boc-amino)cyclopentanecarboxylic Acid

Work with 1-tert-Butoxycarbonylaminocyclopentanecarboxylic acid

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-[(tert-Butoxycarbonyl)amino]cyclopropanecarboxylic acid88950-64-588 % similar 4-[[(1,1-Dimethylethoxy)carbonyl]amino]tetrahydro-2H-pyran-4-carboxylic acid172843-97-978 % similar N-((1,1-Dimethylethoxy)carbonyl)-2-methyl-alanine30992-29-161 % similar N-[(1,1-Dimethylethoxy)carbonyl]-2-methyl-L-serine84311-19-357 % similar (1R,2S)-1-(((1,1-Dimethylethoxy)carbonyl)amino)-2-ethenylcyclopropanecarboxylic acid159622-10-350 % similar 1-(9H-Fluoren-9-ylmethyl) 4-[[(1,1-dimethylethoxy)carbonyl]amino]-1,4-piperidinedicarboxylate368866-07-348 % similar 1-tert-Butoxycarbonylamino-cyclohexanecarboxylic acid115951-16-147 % similar 1,1-Dimethylethyl N-(4-methyl-4-piperidinyl)carbamate163271-08-746 % similar

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

Same formula

2-((2R)-1-((tert-Butoxy)carbonyl)pyrrolidin-2-yl)acetic acid101555-60-6 (S)-(-)-3-tert-Butoxycarbonyl-4-formyl-2,2-dimethyl-1,3-oxazolidine102308-32-7 (2S)-1-(tert-Butoxycarbonyl)-2-methylpyrrolidine-2-carboxylic acid103336-06-7 L-Glutamic acid 5-cyclohexyl ester112471-82-6 1-[(tert-Butoxy)carbonyl]piperidine-2-carboxylic acid118552-55-9 1-tert-Butyl 3-methyl pyrrolidine-1,3-dicarboxylate122684-33-7 Methyl cis-3-(boc-amino)C...142733-63-9 (αS)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]cyclobutaneacetic acid155905-77-4

Elsewhere

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