chempirical

(S)-2-Amino-5-(naphthalen-2-ylamino)-5-oxopentanoic acid

C15H16N2O3CAS 14525-44-1272.30 g/mol

Open in Covalent MOL file
H2NOHNOOH
Carboxylic acidPrimary amine

Properties

Molecular formula
C15H16N2O3
Molar mass
272.30 g/mol
Exact mass
272.1161 Da
logP
2.62Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

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
14525-44-1
SMILES
N[C@@H](CCC(O)=Nc1ccc2ccccc2c1)C(=O)O
InChIKey
XWCSDVVHAXLZNL-ZDUSSCGKSA-N
InChI
InChI=1S/C15H16N2O3/c16-13(15(19)20)7-8-14(18)17-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H,17,18)(H,19,20)/t13-/m0/s1

Weigh it out

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

Names and synonyms

6 names
  • N-2-Naphthalenyl-L-glutamine
  • L-Glutamine, N-2-naphthalenyl-
  • Glutamine, N-2-naphthyl-, L-
  • γ-L-Glutamyl-β-naphthylamide
  • γ-Glutamyl-β-naphthylamide
  • (2S)-2-Amino-5-(naphthalen-2-ylamino)-5-oxopentanoic acid

Work with (S)-2-Amino-5-(naphthalen-2-ylamino)-5-oxopentanoic 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-(Triphenylmethyl)-L-glutamine102747-84-256 % similar Alpha-Amino-2-naphthalenepropanoic acid14108-60-255 % similar 2-Naphthylalanine58438-03-255 % similar D-3-(2-Naphthyl)alanine76985-09-655 % similar Benzoic acid, 5-[(4-amino-4-carboxy-1-oxobutyl)amino]-2-nitro-, monoammonium salt, (S)-63699-78-552 % similar (2S)-2-Amino-3-(naphthalen-2-yl)propanoic acid hydrochloride122745-12-452 % similar Pyrrolidonyl-β-naphthylamide22155-91-552 % similar L-Theanine3081-61-648 % similar

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

Same formula

5-Methyl-2-isopropyloxy-4-(pyridine-4-YL)-nitrobenzene1032903-62-0 4-Benzoylamino-2,5-dimethoxyaniline6268-05-9 5-Ethyl-2-[2-(4-nitrophenoxy)ethyl]pyridine85583-54-6

Elsewhere

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