chempirical

2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]-2-methylpropionic acid

C19H19NO4CAS 94744-50-0325.36 g/mol

Open in Covalent MOL file
NHOOOHO
Carboxylic acid

Properties

Molecular formula
C19H19NO4
Molar mass
325.36 g/mol
Exact mass
325.1314 Da
logP
3.59Crippen estimate
Polar surface area
79.1 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4

Identifiers

CAS number
94744-50-0
SMILES
CC(C)(N=C(O)OCC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey
HOZZVEPRYYCBTO-UHFFFAOYSA-N
InChI
InChI=1S/C19H19NO4/c1-19(2,17(21)22)20-18(23)24-11-16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-10,16H,11H2,1-2H3,(H,20,23)(H,21,22)

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Names and synonyms

6 names
  • Alanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-methyl-
  • N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-methylalanine
  • N-9-Fluorenylmethoxycarbonyl-α-aminoisobutyric acid
  • 2-(9H-Fluoren-9-ylmethoxycarbonylamino)-2-methylpropanoic acid
  • 2-([[(9H-Fluoren-9-yl)methoxy]carbonyl]amino)-2-methylpropanoic acid
  • 2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-2-methylpropanoic acid

Work with 2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]-2-methylpropionic 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

N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2-methyl-L-leucine312624-65-069 % similar O-(1,1-Dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-methyl-L-serine914399-98-769 % similar 1-[(Fmoc)amino]cyclohexanecarboxylic acid162648-54-668 % similar Fmoc-gly-oh29022-11-556 % similar N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-alanine35661-39-356 % similar N-(9-Fluorenylmethoxycarbonyl)-D-alanine79990-15-156 % similar N-(9-Fluorenylmethoxycarbonyl)-O-tert-butylserine71989-33-855 % similar 1-(9H-Fluoren-9-ylmethyl) 4-[[(1,1-dimethylethoxy)carbonyl]amino]-1,4-piperidinedicarboxylate368866-07-355 % similar

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

Same formula

Fmoc-gamma-abu-oh116821-47-7 (2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)butanoic acid135112-27-5 (4S,5R)-3-Benzoyl-2,2-dimethyl-4-phenyloxazolidine-5-carboxylic acid153652-70-1 N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-methyl-L-alanine84000-07-7

Elsewhere

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