(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one

C15H23NO2Si — CID 10826417

IUPAC(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one
SMILESCC[Si](CC)(CC)O[C@H]1C(=O)N[C@H]1c1ccccc1
InChIInChI=1S/C15H23NO2Si/c1-4-19(5-2,6-3)18-14-13(16-15(14)17)12-10-8-7-9-11-12/h7-11,13-14H,4-6H2,1-3H3,(H,16,17)/t13-,14+/m0/s1
InChIKeyFZWHCVWKYWKZHE-UONOGXRCSA-N
MW277.44 g/mol
LogP3.25
Rot. Bonds6

About (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one

(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one (PubChem CID 10826417) has the molecular formula C15H23NO2Si and a molecular weight of 277.44 g/mol. Its IUPAC name is (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one.

Molecular Properties

Compound Name(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one
PubChem CID10826417
Molecular FormulaC15H23NO2Si
Molecular Weight277.44 g/mol
Exact Mass277.15
IUPAC Name(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one
SMILESCC[Si](CC)(CC)O[C@H]1C(=O)N[C@H]1c1ccccc1
InChIInChI=1S/C15H23NO2Si/c1-4-19(5-2,6-3)18-14-13(16-15(14)17)12-10-8-7-9-11-12/h7-11,13-14H,4-6H2,1-3H3,(H,16,17)/t13-,14+/m0/s1
InChIKeyFZWHCVWKYWKZHE-UONOGXRCSA-N
XLogP3.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one?
The IUPAC name of (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one (CID 10826417) is (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one.
What is the SMILES notation for (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one?
The canonical SMILES for (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one is CC[Si](CC)(CC)O[C@H]1C(=O)N[C@H]1c1ccccc1.
What is the InChIKey of (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one?
The InChIKey is FZWHCVWKYWKZHE-UONOGXRCSA-N. The full InChI is InChI=1S/C15H23NO2Si/c1-4-19(5-2,6-3)18-14-13(16-15(14)17)12-10-8-7-9-11-12/h7-11,13-14H,4-6H2,1-3H3,(H,16,17)/t13-,14+/m0/s1.
What are the key properties of (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one?
(3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one has a molecular weight of 277.44 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-4-phenyl-3-triethylsilyloxyazetidin-2-one is sourced from PubChem (CID 10826417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).