(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one

C13H25NO3Si — CID 141191572

IUPAC(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one
SMILESCC(=O)[C@H]1CC(=O)N1C(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H25NO3Si/c1-9(15)11-8-12(16)14(11)10(2)17-18(6,7)13(3,4)5/h10-11H,8H2,1-7H3/t10?,11-/m1/s1
InChIKeyBRTBETVFSAJLCL-RRKGBCIJSA-N
MW271.43 g/mol
LogP2.54
Rot. Bonds4

About (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one

(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one (PubChem CID 141191572) has the molecular formula C13H25NO3Si and a molecular weight of 271.43 g/mol. Its IUPAC name is (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one.

Molecular Properties

Compound Name(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one
PubChem CID141191572
Molecular FormulaC13H25NO3Si
Molecular Weight271.43 g/mol
Exact Mass271.16
IUPAC Name(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one
SMILESCC(=O)[C@H]1CC(=O)N1C(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H25NO3Si/c1-9(15)11-8-12(16)14(11)10(2)17-18(6,7)13(3,4)5/h10-11H,8H2,1-7H3/t10?,11-/m1/s1
InChIKeyBRTBETVFSAJLCL-RRKGBCIJSA-N
XLogP2.54
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.43
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one?
The IUPAC name of (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one (CID 141191572) is (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one.
What is the SMILES notation for (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one?
The canonical SMILES for (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one is CC(=O)[C@H]1CC(=O)N1C(C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one?
The InChIKey is BRTBETVFSAJLCL-RRKGBCIJSA-N. The full InChI is InChI=1S/C13H25NO3Si/c1-9(15)11-8-12(16)14(11)10(2)17-18(6,7)13(3,4)5/h10-11H,8H2,1-7H3/t10?,11-/m1/s1.
What are the key properties of (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one?
(4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one has a molecular weight of 271.43 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-acetyl-1-[1-[tert-butyl(dimethyl)silyl]oxyethyl]azetidin-2-one is sourced from PubChem (CID 141191572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).