(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one

C13H27NO2Si — CID 135042131

IUPAC(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one
SMILESC[C@@H](C[C@H]1CCC(=O)N1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-10(9-11-7-8-12(15)14-11)16-17(5,6)13(2,3)4/h10-11H,7-9H2,1-6H3,(H,14,15)/t10-,11+/m0/s1
InChIKeyVGBYTOZANGEQPE-WDEREUQCSA-N
MW257.45 g/mol
LogP3.07
Rot. Bonds4

About (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one

(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one (PubChem CID 135042131) has the molecular formula C13H27NO2Si and a molecular weight of 257.45 g/mol. Its IUPAC name is (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one
PubChem CID135042131
Molecular FormulaC13H27NO2Si
Molecular Weight257.45 g/mol
Exact Mass257.18
IUPAC Name(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one
SMILESC[C@@H](C[C@H]1CCC(=O)N1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H27NO2Si/c1-10(9-11-7-8-12(15)14-11)16-17(5,6)13(2,3)4/h10-11H,7-9H2,1-6H3,(H,14,15)/t10-,11+/m0/s1
InChIKeyVGBYTOZANGEQPE-WDEREUQCSA-N
XLogP3.07
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.45
LogP ≤ 53.07
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

(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]-1-methylpyrrolidin-2-one
CID 135042206
(4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-(2-methylpropyl)pyrrolidin-2-one
CID 11780641
(5S)-5-(2-{[tert-Butyl(dimethyl)silyl]oxy}ethyl)pyrrolidin-2-one
CID 16202577
(4R,5S)-4-(tert-butyldimethylsilyloxy)-5-ethylpyrrolidin-2-one
CID 59557019
(4S,5S)-4-(tert-butyldimethylsilyloxy)-5-ethylpyrrolidin-2-one
CID 67105254
4-[Tert-butyl(dimethyl)silyl]oxy-5-ethylpyrrolidin-2-one
CID 72325748
5-[2-[Tert-butyl(dimethyl)silyl]oxyethyl]pyrrolidin-2-one
CID 85920196
(5R)-5-[2-[tert-butyl(dimethyl)silyl]oxy-1-[(2R)-oxiran-2-yl]ethyl]pyrrolidin-2-one
CID 90303316
(4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-ethylpyrrolidin-2-one
CID 141620038
3-[Tert-butyl(dimethyl)silyl]oxy-5-propan-2-ylpyrrolidin-2-one
CID 141651202
3-[Tert-butyl(dimethyl)silyl]oxy-5-ethylpyrrolidin-2-one
CID 141651208
3-[Tert-butyl(dimethyl)silyl]oxy-5-propylpyrrolidin-2-one
CID 141651217

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one?
The IUPAC name of (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one (CID 135042131) is (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one.
What is the SMILES notation for (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one?
The canonical SMILES for (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one is C[C@@H](C[C@H]1CCC(=O)N1)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one?
The InChIKey is VGBYTOZANGEQPE-WDEREUQCSA-N. The full InChI is InChI=1S/C13H27NO2Si/c1-10(9-11-7-8-12(15)14-11)16-17(5,6)13(2,3)4/h10-11H,7-9H2,1-6H3,(H,14,15)/t10-,11+/m0/s1.
What are the key properties of (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one?
(5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one has a molecular weight of 257.45 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(2S)-2-[tert-butyl(dimethyl)silyl]oxypropyl]pyrrolidin-2-one is sourced from PubChem (CID 135042131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).