(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one

C11H20F3NO2Si — CID 11414884

IUPAC(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one
SMILESCC[Si](CC)(CC)O[C@@]1(C)C(=O)N[C@H]1C(F)(F)F
InChIInChI=1S/C11H20F3NO2Si/c1-5-18(6-2,7-3)17-10(4)8(11(12,13)14)15-9(10)16/h8H,5-7H2,1-4H3,(H,15,16)/t8-,10-/m1/s1
InChIKeyFQTGKPFTPMUGFZ-PSASIEDQSA-N
MW283.37 g/mol
LogP2.83
Rot. Bonds5

About (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one

(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one (PubChem CID 11414884) has the molecular formula C11H20F3NO2Si and a molecular weight of 283.37 g/mol. Its IUPAC name is (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one.

Molecular Properties

Compound Name(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one
PubChem CID11414884
Molecular FormulaC11H20F3NO2Si
Molecular Weight283.37 g/mol
Exact Mass283.12
IUPAC Name(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one
SMILESCC[Si](CC)(CC)O[C@@]1(C)C(=O)N[C@H]1C(F)(F)F
InChIInChI=1S/C11H20F3NO2Si/c1-5-18(6-2,7-3)17-10(4)8(11(12,13)14)15-9(10)16/h8H,5-7H2,1-4H3,(H,15,16)/t8-,10-/m1/s1
InChIKeyFQTGKPFTPMUGFZ-PSASIEDQSA-N
XLogP2.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.83
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-(trifluoromethyl)-3-tri(propan-2-yl)silyloxyazetidin-2-one
CID 12986340
(3R,4R)-4-(difluoromethyl)-3-methyl-3-triethylsilyloxyazetidin-2-one
CID 57784754
(3R,4R)-4-(fluoromethyl)-3-methyl-3-triethylsilyloxyazetidin-2-one
CID 57784820
(3R,4R)-4-(Difluoromethyl)-3-[(triisopropylsilyl)oxy]-2-azetidinone
CID 57784871
(3R,4R)-4-[(1S)-1-Fluoroethyl]-3-methyl-3-[(triethylsilyl)oxy]-2-azetidinone
CID 57784911
(3R,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-(difluoromethyl)-3-methylazetidin-2-one
CID 57784921
(3R,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-(1,1-difluoroethyl)-3-methylazetidin-2-one
CID 57784949
3-Methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one
CID 72952499
(3R,4S)-3-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethyl)azetidin-2-one
CID 100980511
(3R,4S)-4-ethyl-3-methyl-3-triethylsilyloxyazetidin-2-one
CID 57784810
(3R)-3-methyl-4-(2-trimethylsilylethynyl)-3-trimethylsilyloxyazetidin-2-one
CID 10754471

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one?
The IUPAC name of (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one (CID 11414884) is (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one.
What is the SMILES notation for (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one?
The canonical SMILES for (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one is CC[Si](CC)(CC)O[C@@]1(C)C(=O)N[C@H]1C(F)(F)F.
What is the InChIKey of (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one?
The InChIKey is FQTGKPFTPMUGFZ-PSASIEDQSA-N. The full InChI is InChI=1S/C11H20F3NO2Si/c1-5-18(6-2,7-3)17-10(4)8(11(12,13)14)15-9(10)16/h8H,5-7H2,1-4H3,(H,15,16)/t8-,10-/m1/s1.
What are the key properties of (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one?
(3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one has a molecular weight of 283.37 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-3-methyl-3-triethylsilyloxy-4-(trifluoromethyl)azetidin-2-one is sourced from PubChem (CID 11414884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).