(5R,6S)-5,6-Diphenyl-2-morpholinone

C₁₆H₁₅NO₂CAS 282735-66-4253.30 g/mol

Open in Covalent MOL file

Ester Lactone Secondary amine

Properties

Molecular formula: C₁₆H₁₅NO₂
Molar mass: 253.30 g/mol
Exact mass: 253.1103 Da
logP: 2.62Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2
Stereocentres: S, Rin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H332 Harmful if inhaled100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P301+P317, P304+P340, P317, P330, P501

Identifiers

CAS number

282735-66-4

SMILES

C1C(=O)O[C@H]([C@H](N1)C2=CC=CC=C2)C3=CC=CC=C3

InChIKey

LTPOSIZJPSDSIL-CVEARBPZSA-N

InChI

InChI=1S/C16H15NO2/c18-14-11-17-15(12-7-3-1-4-8-12)16(19-14)13-9-5-2-6-10-13/h1-10,15-17H,11H2/t15-,16+/m1/s1

Weigh it out

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

Names and synonyms

1 names

(5R,6S)-5.6-Diphenyl-2-morpholinone

Work with (5R,6S)-5,6-Diphenyl-2-morpholinone

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(5S,6R)-5,6-Diphenyl-2-morpholinone144538-22-7Enantiomer

Similar compounds

Gamma-Phenyl-gamma-butyrolactone1008-76-047 % similar Benzyl (2R,3S)-(-)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate100516-54-943 % similar 1-Phenylethyl propionate120-45-640 % similar (4S,5R)-(-)-4-Methyl-5-phenyl-2-oxazolidinone16251-45-940 % similar (4R,5S)-(+)-4-Methyl-5-phenyl-2-oxazolidinone77943-39-640 % similar (S)-(+)-4-Phenyl-2-oxazolidinone86217-38-140 % similar tert-Butyl (2R,3S)-6-oxo-2,3-diphenylmorpholine-4-carboxylate112741-49-839 % similar 1,1-Dimethylethyl (2S,3R)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate112741-50-139 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-(Cinnamoyl)-3-methoxyaniline127033-74-3 4-Benzyloxy-3-methoxyphenylacetonitrile1700-29-4 5,6-Dimethoxy-2-phenylindole62663-26-7 Methyl N-(diphenylmethylidene)glycinate81167-39-7

Elsewhere

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