4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one

C20H25NO2Si — CID 73318327

IUPAC4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
SMILESCC(C)(C)[Si](OC1CNC(=O)C1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2Si/c1-20(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-14-19(22)21-15-16/h4-13,16H,14-15H2,1-3H3,(H,21,22)
InChIKeyGROJBIVJKSYMFY-UHFFFAOYSA-N
MW339.51 g/mol
LogP2.45
Rot. Bonds4

About 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one

4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one (PubChem CID 73318327) has the molecular formula C20H25NO2Si and a molecular weight of 339.51 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
PubChem CID73318327
Molecular FormulaC20H25NO2Si
Molecular Weight339.51 g/mol
Exact Mass339.17
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
SMILESCC(C)(C)[Si](OC1CNC(=O)C1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2Si/c1-20(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-14-19(22)21-15-16/h4-13,16H,14-15H2,1-3H3,(H,21,22)
InChIKeyGROJBIVJKSYMFY-UHFFFAOYSA-N
XLogP2.45
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.51
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(S)-5-(((tert-Butyldiphenylsilyl)oxy)methyl)pyrrolidin-2-one
CID 10882735
tert-butyl-diphenyl-[(3R)-pyrrolidin-3-yl]oxy-silane
CID 58393504
tert-butyl-[(3S,4S)-4-fluoropyrrolidin-3-yl]oxy-diphenylsilane
CID 140882011
(3R,4R)-3-fluoro-4-[hydroxy(diphenyl)silyl]oxy-5-(methoxymethyl)-3-methylpyrrolidin-2-one
CID 163935108
(5R)-5-[(tert-Butyldiphenylsilyloxy)methyl]pyrrolidine-2-one
CID 10948196
(4S,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-hydroxypyrrolidin-2-one
CID 11003169
(5S)-5-[(Z)-6-[tert-butyl(diphenyl)silyl]oxyhex-1-enyl]pyrrolidin-2-one
CID 45103028
(4r)-4-[t-Butyl(diphenyl)silyloxy]-3,3-dimeth-ylpyrrolidine-2,5-dione
CID 129758514
(3r)-3-[t-Butyl(diphenyl)silyloxy]-5-hydroxy-4,4-dimethylpyrrolidin-2-one
CID 129758526
(5S)-5-[(1R)-1-[tert-butyl(diphenyl)silyl]oxybut-3-enyl]pyrrolidin-2-one
CID 135013759
(4R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-hydroxypyrrolidin-2-one
CID 11760411
(4R)-4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
CID 16742491

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one (CID 73318327) is 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one is CC(C)(C)[Si](OC1CNC(=O)C1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The InChIKey is GROJBIVJKSYMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2Si/c1-20(2,3)24(17-10-6-4-7-11-17,18-12-8-5-9-13-18)23-16-14-19(22)21-15-16/h4-13,16H,14-15H2,1-3H3,(H,21,22).
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one has a molecular weight of 339.51 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one is sourced from PubChem (CID 73318327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).