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

C20H25NO2Si — CID 102114828

IUPAC5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
SMILESCC(C)(C)[Si](OC1CCC(=O)N1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2Si/c1-20(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-19-15-14-18(22)21-19/h4-13,19H,14-15H2,1-3H3,(H,21,22)
InChIKeyNAMPSRDFNNEDBQ-UHFFFAOYSA-N
MW339.51 g/mol
LogP2.80
Rot. Bonds4

About 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one

5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one (PubChem CID 102114828) has the molecular formula C20H25NO2Si and a molecular weight of 339.51 g/mol. Its IUPAC name is 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one.

Molecular Properties

Compound Name5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
PubChem CID102114828
Molecular FormulaC20H25NO2Si
Molecular Weight339.51 g/mol
Exact Mass339.17
IUPAC Name5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
SMILESCC(C)(C)[Si](OC1CCC(=O)N1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO2Si/c1-20(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-19-15-14-18(22)21-19/h4-13,19H,14-15H2,1-3H3,(H,21,22)
InChIKeyNAMPSRDFNNEDBQ-UHFFFAOYSA-N
XLogP2.80
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 ≤ 52.80
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
(5R)-5-[(tert-Butyldiphenylsilyloxy)methyl]pyrrolidine-2-one
CID 10948196
(5S)-5-[(Z)-6-[tert-butyl(diphenyl)silyl]oxyhex-1-enyl]pyrrolidin-2-one
CID 45103028
(3R,4S,5R)-5-[tert-butyl(dimethyl)silyl]oxy-4-[dimethyl(phenyl)silyl]-3,4-dimethylpyrrolidin-2-one
CID 102184859
(3r)-3-[t-Butyl(diphenyl)silyloxy]-5-hydroxy-4,4-dimethylpyrrolidin-2-one
CID 129758526
(4R)-4-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
CID 16742491
1-[1-[Tert-butyl(diphenyl)silyl]oxypropan-2-yl]pyrrolidin-2-one
CID 18318463
5-(tert-Butyldiphenylsiloxymethyl)pyrrolidine-2-one
CID 58011546
N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide
CID 69025615
(S)-2-(2-oxopyrrolidin-1-yl)propyl tert-butyldiphenylsilyl ether
CID 69946440
1-[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]pyrrolidin-2-one
CID 69948287
4-[Tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one
CID 73318327

Frequently Asked Questions

What is the IUPAC name of 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The IUPAC name of 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one (CID 102114828) is 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one.
What is the SMILES notation for 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The canonical SMILES for 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one is CC(C)(C)[Si](OC1CCC(=O)N1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
The InChIKey is NAMPSRDFNNEDBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2Si/c1-20(2,3)24(16-10-6-4-7-11-16,17-12-8-5-9-13-17)23-19-15-14-18(22)21-19/h4-13,19H,14-15H2,1-3H3,(H,21,22).
What are the key properties of 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one?
5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one has a molecular weight of 339.51 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(diphenyl)silyl]oxypyrrolidin-2-one is sourced from PubChem (CID 102114828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).