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

C21H27NO2Si — CID 124674078

IUPAC(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one
SMILESCC(C)(C)[Si](O[C@@H]1CCNC(=O)C1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H27NO2Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)24-17-14-15-22-20(23)16-17/h4-13,17H,14-16H2,1-3H3,(H,22,23)/t17-/m1/s1
InChIKeyXAUGMOKNWLXHRX-QGZVFWFLSA-N
MW353.54 g/mol
LogP2.84
Rot. Bonds4

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

(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one (PubChem CID 124674078) has the molecular formula C21H27NO2Si and a molecular weight of 353.54 g/mol. Its IUPAC name is (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one.

Molecular Properties

Compound Name(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one
PubChem CID124674078
Molecular FormulaC21H27NO2Si
Molecular Weight353.54 g/mol
Exact Mass353.18
IUPAC Name(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one
SMILESCC(C)(C)[Si](O[C@@H]1CCNC(=O)C1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H27NO2Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)24-17-14-15-22-20(23)16-17/h4-13,17H,14-16H2,1-3H3,(H,22,23)/t17-/m1/s1
InChIKeyXAUGMOKNWLXHRX-QGZVFWFLSA-N
XLogP2.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.54
LogP ≤ 52.84
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

tert-butyl-diphenyl-[(3R)-pyrrolidin-3-yl]oxysilane
CID 58393504
tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane
CID 11347853
[(3S)-azepan-3-yl]oxy-tert-butyl-diphenylsilane
CID 177203387
(4R)-4-[tert-butyl(diphenyl)silyl]oxy-1-methylpyrrolidin-2-one
CID 171692304
3-bicyclo[3.1.0]hexanyloxy-tert-butyl-diphenylsilane
CID 154401251
3-[tert-butyl(diphenyl)silyl]oxycyclobutan-1-ol
CID 59414974
5-[[tert-butyl(diphenyl)silyl]oxymethyl]pyrrolidin-2-one
CID 58011546
methyl (5S)-5-[tert-butyl(diphenyl)silyl]oxy-2-hydroxycyclohexene-1-carboxylate
CID 54720201
(1S,2R,4R)-4-[tert-butyl(diphenyl)silyl]oxycyclohexane-1,2-diamine
CID 177070919
tert-butyl 5-[tert-butyl(diphenyl)silyl]oxy-2-oxopiperidine-1-carboxylate
CID 131747989
4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine
CID 142751894
tert-butyl-(3-oxabicyclo[3.2.1]octan-8-yloxy)-diphenylsilane
CID 171553746

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one?
The IUPAC name of (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one (CID 124674078) is (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one.
What is the SMILES notation for (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one?
The canonical SMILES for (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one is CC(C)(C)[Si](O[C@@H]1CCNC(=O)C1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one?
The InChIKey is XAUGMOKNWLXHRX-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H27NO2Si/c1-21(2,3)25(18-10-6-4-7-11-18,19-12-8-5-9-13-19)24-17-14-15-22-20(23)16-17/h4-13,17H,14-16H2,1-3H3,(H,22,23)/t17-/m1/s1.
What are the key properties of (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one?
(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one has a molecular weight of 353.54 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one is sourced from PubChem (CID 124674078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).