tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane

C16H27NO2Si — CID 134925486

IUPACtert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane
SMILESCN1O[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1c1ccccc1
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(5,6)19-15-12-14(17(4)18-15)13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3/t14-,15+/m0/s1
InChIKeyZWODGCFBUCILMI-LSDHHAIUSA-N
MW293.48 g/mol
LogP4.34
Rot. Bonds3

About tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane

tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane (PubChem CID 134925486) has the molecular formula C16H27NO2Si and a molecular weight of 293.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane
PubChem CID134925486
Molecular FormulaC16H27NO2Si
Molecular Weight293.48 g/mol
Exact Mass293.18
IUPAC Nametert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane
SMILESCN1O[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1c1ccccc1
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(5,6)19-15-12-14(17(4)18-15)13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3/t14-,15+/m0/s1
InChIKeyZWODGCFBUCILMI-LSDHHAIUSA-N
XLogP4.34
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.48
LogP ≤ 54.34
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

(3R,5R)-2-methyl-3-phenyl-5-prop-2-enyl-1,2-oxazolidine
CID 10420426
(3S)-2-benzyl-3-phenyl-1,2-oxazolidine
CID 11413758
[(3R,5R)-2-benzyl-3-propan-2-yl-1,2-oxazolidin-5-yl]oxy-tert-butyl-dimethylsilane
CID 15685050
tert-butyl-dimethyl-[[(3R,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane
CID 15685054
(3S,5S)-5-ethoxy-2-methyl-3-phenyl-1,2-oxazolidine
CID 93504493
(3S,5R)-5-ethoxy-2-methyl-3-phenyl-1,2-oxazolidine
CID 93504494
(3S,5S)-2-benzyl-5-ethoxy-3-phenyl-1,2-oxazolidine
CID 100914315
(3S,5R)-2-benzyl-5-ethoxy-3-phenyl-1,2-oxazolidine
CID 100914316
carbon monoxide;chromium;(3S,5R)-5-ethoxy-2-methyl-3-phenyl-1,2-oxazolidine
CID 134899175
carbon monoxide;chromium;[2-[(3S,5R)-5-ethoxy-2-methyl-1,2-oxazolidin-3-yl]phenyl]-trimethylsilane
CID 134899199
[(3S,5R)-2-benzyl-3-ethyl-1,2-oxazolidin-5-yl]oxy-tert-butyl-dimethylsilane
CID 134924653
3-(2-Fluorophenyl)-2-methyl-1,2-oxazolidine
CID 129018500

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane (CID 134925486) is tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane is CN1O[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1c1ccccc1.
What is the InChIKey of tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane?
The InChIKey is ZWODGCFBUCILMI-LSDHHAIUSA-N. The full InChI is InChI=1S/C16H27NO2Si/c1-16(2,3)20(5,6)19-15-12-14(17(4)18-15)13-10-8-7-9-11-13/h7-11,14-15H,12H2,1-6H3/t14-,15+/m0/s1.
What are the key properties of tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane?
tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane has a molecular weight of 293.48 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(3S,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]oxy]silane is sourced from PubChem (CID 134925486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).