4-tert-butyl-3-triethylsilyloxyazetidin-2-one

C13H27NO2Si — CID 22382236

IUPAC4-tert-butyl-3-triethylsilyloxyazetidin-2-one
SMILESCC[Si](CC)(CC)OC1C(=O)NC1C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-7-17(8-2,9-3)16-10-11(13(4,5)6)14-12(10)15/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKeySFDILAPFGUPFFL-UHFFFAOYSA-N
MW257.45 g/mol
LogP2.92
Rot. Bonds5

About 4-tert-butyl-3-triethylsilyloxyazetidin-2-one

4-tert-butyl-3-triethylsilyloxyazetidin-2-one (PubChem CID 22382236) has the molecular formula C13H27NO2Si and a molecular weight of 257.45 g/mol. Its IUPAC name is 4-tert-butyl-3-triethylsilyloxyazetidin-2-one.

Molecular Properties

Compound Name4-tert-butyl-3-triethylsilyloxyazetidin-2-one
PubChem CID22382236
Molecular FormulaC13H27NO2Si
Molecular Weight257.45 g/mol
Exact Mass257.18
IUPAC Name4-tert-butyl-3-triethylsilyloxyazetidin-2-one
SMILESCC[Si](CC)(CC)OC1C(=O)NC1C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-7-17(8-2,9-3)16-10-11(13(4,5)6)14-12(10)15/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKeySFDILAPFGUPFFL-UHFFFAOYSA-N
XLogP2.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.45
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3R,4R)-4-[(1S)-1-fluoroethyl]-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 57784762
(3R,4R)-4-(1,1-difluoroethyl)-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 57784782
(3R,4R)-4-[(1R)-1,2-difluoroethyl]-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 57784847
(3R,4R)-4-[(1S)-1-Fluoroethyl]-3-methyl-3-[(triethylsilyl)oxy]-2-azetidinone
CID 57784911
4-(1,1-Difluoroethyl)-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 68944765
cis-4-(1,1-Difluoroethyl)-3-[(triisopropylsilyl)oxy]-2-azetidinone
CID 68944766
(3R,4S)-3-[tert-butyl(dimethyl)silyl]oxy-4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]azetidin-2-one
CID 91357845
(3R,4S)-4-(2-methylpropyl)-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 10859536
(3R,4S)-4-propan-2-yl-3-triethylsilyloxyazetidin-2-one
CID 20735665
(3R,4S)-4-tert-butyl-3-triethylsilyloxyazetidin-2-one
CID 20735667
4-Propan-2-yl-3-triethylsilyloxyazetidin-2-one
CID 22382244
(3R,4S)-4-cyclopropyl-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 57784809

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-3-triethylsilyloxyazetidin-2-one?
The IUPAC name of 4-tert-butyl-3-triethylsilyloxyazetidin-2-one (CID 22382236) is 4-tert-butyl-3-triethylsilyloxyazetidin-2-one.
What is the SMILES notation for 4-tert-butyl-3-triethylsilyloxyazetidin-2-one?
The canonical SMILES for 4-tert-butyl-3-triethylsilyloxyazetidin-2-one is CC[Si](CC)(CC)OC1C(=O)NC1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-3-triethylsilyloxyazetidin-2-one?
The InChIKey is SFDILAPFGUPFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2Si/c1-7-17(8-2,9-3)16-10-11(13(4,5)6)14-12(10)15/h10-11H,7-9H2,1-6H3,(H,14,15).
What are the key properties of 4-tert-butyl-3-triethylsilyloxyazetidin-2-one?
4-tert-butyl-3-triethylsilyloxyazetidin-2-one has a molecular weight of 257.45 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-3-triethylsilyloxyazetidin-2-one is sourced from PubChem (CID 22382236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).