tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate

C15H29NO3Si — CID 11141095

IUPACtert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate
SMILESCC(C)(C)OC(=O)N1[C@H](/C=C/[Si](C)(C)C)COC1(C)C
InChIInChI=1S/C15H29NO3Si/c1-14(2,3)19-13(17)16-12(9-10-20(6,7)8)11-18-15(16,4)5/h9-10,12H,11H2,1-8H3/b10-9+/t12-/m1/s1
InChIKeyFXOGWHAYHBHJQT-BZYZDCJZSA-N
MW299.49 g/mol
LogP3.79
Rot. Bonds2

About tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate

tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate (PubChem CID 11141095) has the molecular formula C15H29NO3Si and a molecular weight of 299.49 g/mol. Its IUPAC name is tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate.

Molecular Properties

Compound Nametert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate
PubChem CID11141095
Molecular FormulaC15H29NO3Si
Molecular Weight299.49 g/mol
Exact Mass299.19
IUPAC Nametert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate
SMILESCC(C)(C)OC(=O)N1[C@H](/C=C/[Si](C)(C)C)COC1(C)C
InChIInChI=1S/C15H29NO3Si/c1-14(2,3)19-13(17)16-12(9-10-20(6,7)8)11-18-15(16,4)5/h9-10,12H,11H2,1-8H3/b10-9+/t12-/m1/s1
InChIKeyFXOGWHAYHBHJQT-BZYZDCJZSA-N
XLogP3.79
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.49
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4R)-2,2-Dimethyl-4-vinyloxazolidine-3-carboxylic acid tert-butyl ester
CID 10878894
tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-tributylstannylethenyl]-1,3-oxazolidine-3-carboxylate
CID 10697188
tert-butyl (4R)-4-[(E)-2-iodoethenyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
CID 10807963
tert-butyl (4R)-2,2-dimethyl-4-(3-trimethylsilylpropa-1,2-dienyl)-1,3-oxazolidine-3-carboxylate
CID 102278746
Tert-butyl 2,2-dimethyl-4-vinyloxazolidine-3-carboxylate
CID 13905152
1,1-Dimethylethyl (4S)-2,2-dimethyl-4-(1Z)-1-propen-1-yl-3-oxazolidinecarboxylate
CID 11107506
tert-butyl (2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,5-dihydropyrrole-1-carboxylate
CID 16091114
tert-butyl (4R)-2,2-dimethyl-4-[(E)-3-trimethylsilylprop-1-enyl]-1,3-oxazolidine-3-carboxylate
CID 57801792
tert-butyl (4S)-2,2-dimethyl-4-(3-trimethylsilylbuta-1,2-dienyl)-1,3-oxazolidine-3-carboxylate
CID 10616070
tert-butyl (4S)-4-(3-bromo-3-trimethylsilylpropa-1,2-dienyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
CID 10644102
tert-butyl (4S)-2,2-dimethyl-4-(3-trimethylsilylhepta-1,2-dienyl)-1,3-oxazolidine-3-carboxylate
CID 10714029
Tert-butyl 2-prop-2-enyl-1,3-oxazolidine-3-carboxylate
CID 91345344

Frequently Asked Questions

What is the IUPAC name of tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate?
The IUPAC name of tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate (CID 11141095) is tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate.
What is the SMILES notation for tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate?
The canonical SMILES for tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate is CC(C)(C)OC(=O)N1[C@H](/C=C/[Si](C)(C)C)COC1(C)C.
What is the InChIKey of tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate?
The InChIKey is FXOGWHAYHBHJQT-BZYZDCJZSA-N. The full InChI is InChI=1S/C15H29NO3Si/c1-14(2,3)19-13(17)16-12(9-10-20(6,7)8)11-18-15(16,4)5/h9-10,12H,11H2,1-8H3/b10-9+/t12-/m1/s1.
What are the key properties of tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate?
tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate has a molecular weight of 299.49 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (4R)-2,2-dimethyl-4-[(E)-2-trimethylsilylethenyl]-1,3-oxazolidine-3-carboxylate is sourced from PubChem (CID 11141095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).