(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one

C13H27NO2Si — CID 156741324

IUPAC(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one
SMILESCN1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-13(2,3)17(5,6)16-10-9-11-7-8-12(15)14(11)4/h11H,7-10H2,1-6H3/t11-/m1/s1
InChIKeyGTFRNCBAVKOOKH-LLVKDONJSA-N
MW257.45 g/mol
LogP3.02
Rot. Bonds4

About (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one

(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one (PubChem CID 156741324) has the molecular formula C13H27NO2Si and a molecular weight of 257.45 g/mol. Its IUPAC name is (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one
PubChem CID156741324
Molecular FormulaC13H27NO2Si
Molecular Weight257.45 g/mol
Exact Mass257.18
IUPAC Name(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one
SMILESCN1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-13(2,3)17(5,6)16-10-9-11-7-8-12(15)14(11)4/h11H,7-10H2,1-6H3/t11-/m1/s1
InChIKeyGTFRNCBAVKOOKH-LLVKDONJSA-N
XLogP3.02
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.45
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one?
The IUPAC name of (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one (CID 156741324) is (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one.
What is the SMILES notation for (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one?
The canonical SMILES for (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one is CN1C(=O)CC[C@@H]1CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one?
The InChIKey is GTFRNCBAVKOOKH-LLVKDONJSA-N. The full InChI is InChI=1S/C13H27NO2Si/c1-13(2,3)17(5,6)16-10-9-11-7-8-12(15)14(11)4/h11H,7-10H2,1-6H3/t11-/m1/s1.
What are the key properties of (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one?
(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one has a molecular weight of 257.45 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methylpyrrolidin-2-one is sourced from PubChem (CID 156741324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).