tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate

C15H33NO3Si2 — CID 10947531

IUPACtert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CC[C@@H](O[Si](C)(C)C)C1[Si](C)(C)C
InChIInChI=1S/C15H33NO3Si2/c1-15(2,3)18-14(17)16-11-10-12(19-21(7,8)9)13(16)20(4,5)6/h12-13H,10-11H2,1-9H3/t12-,13?/m1/s1
InChIKeyFDDJLNUISUTVPX-PZORYLMUSA-N
MW331.61 g/mol
LogP4.09
Rot. Bonds3

About tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate

tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate (PubChem CID 10947531) has the molecular formula C15H33NO3Si2 and a molecular weight of 331.61 g/mol. Its IUPAC name is tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate
PubChem CID10947531
Molecular FormulaC15H33NO3Si2
Molecular Weight331.61 g/mol
Exact Mass331.20
IUPAC Nametert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CC[C@@H](O[Si](C)(C)C)C1[Si](C)(C)C
InChIInChI=1S/C15H33NO3Si2/c1-15(2,3)18-14(17)16-11-10-12(19-21(7,8)9)13(16)20(4,5)6/h12-13H,10-11H2,1-9H3/t12-,13?/m1/s1
InChIKeyFDDJLNUISUTVPX-PZORYLMUSA-N
XLogP4.09
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.61
LogP ≤ 54.09
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

tert-butyl (2S,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-formylpyrrolidine-1-carboxylate
CID 16732142
(2S,3R)-3-[tert-butyl(dimethyl)silyl]oxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
CID 54215964
tert-butyl (2S)-3-methoxy-2-methylpyrrolidine-1-carboxylate
CID 166870611
tert-butyl (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-(methoxymethyl)pyrrolidine-1-carboxylate
CID 178119932
tert-butyl 2-fluoro-3-methoxypyrrolidine-1-carboxylate
CID 141455162
tert-butyl (2R)-2-trimethylsilylpiperidine-1-carboxylate
CID 11594083
tert-butyl (2R)-2-aminoazetidine-1-carboxylate
CID 25417768
tert-butyl (2S,3R)-2-(tert-butylcarbamoyl)-3-[tert-butyl(dimethyl)silyl]oxypyrrolidine-1-carboxylate
CID 22872710
3-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
CID 22324543
tert-butyl 6-trimethylsilyloxy-3,6-dihydro-2H-pyridine-1-carboxylate
CID 153326433
ditert-butyl azetidine-1,2-dicarboxylate
CID 14821737
tert-butyl (2R)-2-methoxyazetidine-1-carboxylate
CID 174358225

Frequently Asked Questions

What is the IUPAC name of tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate (CID 10947531) is tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate is CC(C)(C)OC(=O)N1CC[C@@H](O[Si](C)(C)C)C1[Si](C)(C)C.
What is the InChIKey of tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate?
The InChIKey is FDDJLNUISUTVPX-PZORYLMUSA-N. The full InChI is InChI=1S/C15H33NO3Si2/c1-15(2,3)18-14(17)16-11-10-12(19-21(7,8)9)13(16)20(4,5)6/h12-13H,10-11H2,1-9H3/t12-,13?/m1/s1.
What are the key properties of tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate?
tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate has a molecular weight of 331.61 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (3R)-2-trimethylsilyl-3-trimethylsilyloxypyrrolidine-1-carboxylate is sourced from PubChem (CID 10947531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).