5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one

C20H25NO3Si — CID 23548100

IUPAC5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one
SMILESCC(C)(C)[Si](OCC1CNC(=O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-15-16-14-21-19(22)24-16/h4-13,16H,14-15H2,1-3H3,(H,21,22)
InChIKeyYAXBNOGFHQICKA-UHFFFAOYSA-N
MW355.51 g/mol
LogP2.67
Rot. Bonds5

About 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one

5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one (PubChem CID 23548100) has the molecular formula C20H25NO3Si and a molecular weight of 355.51 g/mol. Its IUPAC name is 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one
PubChem CID23548100
Molecular FormulaC20H25NO3Si
Molecular Weight355.51 g/mol
Exact Mass355.16
IUPAC Name5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one
SMILESCC(C)(C)[Si](OCC1CNC(=O)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-15-16-14-21-19(22)24-16/h4-13,16H,14-15H2,1-3H3,(H,21,22)
InChIKeyYAXBNOGFHQICKA-UHFFFAOYSA-N
XLogP2.67
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.51
LogP ≤ 52.67
H-Bond Donors ≤ 51
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 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one (CID 23548100) is 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one is CC(C)(C)[Si](OCC1CNC(=O)O1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one?
The InChIKey is YAXBNOGFHQICKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-15-16-14-21-19(22)24-16/h4-13,16H,14-15H2,1-3H3,(H,21,22).
What are the key properties of 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one?
5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one has a molecular weight of 355.51 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 23548100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).