N-2-Naphthalenyl-L-glutamine

C₁₅H₁₆N₂O₃CAS 14525-44-1272.30 g/mol

Open in Covalent MOL file

Carboxylic acid Primary 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 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

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

5 names

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 N-2-Naphthalenyl-L-glutamine

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 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 L-Homophenylalanine943-73-748 % 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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