1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one

C14H31NO3Si2 — CID 22367087

IUPAC1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one
SMILESCCCC[Si](C)(C)OCCN1C(=O)CC1O[Si](C)(C)C
InChIInChI=1S/C14H31NO3Si2/c1-7-8-11-20(5,6)17-10-9-15-13(16)12-14(15)18-19(2,3)4/h14H,7-12H2,1-6H3
InChIKeyFZRQXPPLKFDPJQ-UHFFFAOYSA-N
MW317.58 g/mol
LogP3.42
Rot. Bonds9

About 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one

1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one (PubChem CID 22367087) has the molecular formula C14H31NO3Si2 and a molecular weight of 317.58 g/mol. Its IUPAC name is 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one.

Molecular Properties

Compound Name1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one
PubChem CID22367087
Molecular FormulaC14H31NO3Si2
Molecular Weight317.58 g/mol
Exact Mass317.18
IUPAC Name1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one
SMILESCCCC[Si](C)(C)OCCN1C(=O)CC1O[Si](C)(C)C
InChIInChI=1S/C14H31NO3Si2/c1-7-8-11-20(5,6)17-10-9-15-13(16)12-14(15)18-19(2,3)4/h14H,7-12H2,1-6H3
InChIKeyFZRQXPPLKFDPJQ-UHFFFAOYSA-N
XLogP3.42
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.58
LogP ≤ 53.42
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 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one?
The IUPAC name of 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one (CID 22367087) is 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one.
What is the SMILES notation for 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one?
The canonical SMILES for 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one is CCCC[Si](C)(C)OCCN1C(=O)CC1O[Si](C)(C)C.
What is the InChIKey of 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one?
The InChIKey is FZRQXPPLKFDPJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO3Si2/c1-7-8-11-20(5,6)17-10-9-15-13(16)12-14(15)18-19(2,3)4/h14H,7-12H2,1-6H3.
What are the key properties of 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one?
1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one has a molecular weight of 317.58 g/mol, XLogP of 3.42, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[butyl(dimethyl)silyl]oxyethyl]-4-trimethylsilyloxyazetidin-2-one is sourced from PubChem (CID 22367087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).