(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one

C22H29NO3Si — CID 11383512

IUPAC(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one
SMILESCO[C@H]1C[C@H](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC(=O)N1
InChIInChI=1S/C22H29NO3Si/c1-22(2,3)27(18-11-7-5-8-12-18,19-13-9-6-10-14-19)26-17-15-20(24)23-21(16-17)25-4/h5-14,17,21H,15-16H2,1-4H3,(H,23,24)/t17-,21+/m1/s1
InChIKeyDACXDZATOQEZSW-UTKZUKDTSA-N
MW383.56 g/mol
LogP2.81
Rot. Bonds5

About (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one

(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one (PubChem CID 11383512) has the molecular formula C22H29NO3Si and a molecular weight of 383.56 g/mol. Its IUPAC name is (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one.

Molecular Properties

Compound Name(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one
PubChem CID11383512
Molecular FormulaC22H29NO3Si
Molecular Weight383.56 g/mol
Exact Mass383.19
IUPAC Name(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one
SMILESCO[C@H]1C[C@H](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC(=O)N1
InChIInChI=1S/C22H29NO3Si/c1-22(2,3)27(18-11-7-5-8-12-18,19-13-9-6-10-14-19)26-17-15-20(24)23-21(16-17)25-4/h5-14,17,21H,15-16H2,1-4H3,(H,23,24)/t17-,21+/m1/s1
InChIKeyDACXDZATOQEZSW-UTKZUKDTSA-N
XLogP2.81
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.56
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[Tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one
CID 11036387
(4S)-4-[tert-butyl(diphenyl)silyl]oxy-6-prop-2-ynylpiperidin-2-one
CID 134831232
(5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]piperidin-2-one
CID 138981408
3-({[tert-Butyl(diphenyl)silyl]oxy}methyl)piperidin-2-one
CID 59410781
4-((tert-Butyldiphenylsilyl)oxy)piperidin-2-one
CID 90295657
(4R)-4-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one
CID 124674078
5-[Tert-butyl(diphenyl)silyl]oxypiperidin-2-one
CID 139271638
(5S)-5-[tert-butyl(diphenyl)silyl]oxypiperidin-2-one
CID 173613465
Methyl 4-((tert-butyldiphenylsilyl)oxy)-2-oxopiperidine-1-carboxylate
CID 11058701
(2R,4S)-4-[tert-butyl(diphenyl)silyl]oxy-6-oxopiperidine-2-carbonitrile
CID 11079393
(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-prop-2-ynylpiperidin-2-one
CID 11101237
(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-prop-2-enylpiperidin-2-one
CID 11731967

Frequently Asked Questions

What is the IUPAC name of (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one?
The IUPAC name of (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one (CID 11383512) is (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one.
What is the SMILES notation for (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one?
The canonical SMILES for (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one is CO[C@H]1C[C@H](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC(=O)N1.
What is the InChIKey of (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one?
The InChIKey is DACXDZATOQEZSW-UTKZUKDTSA-N. The full InChI is InChI=1S/C22H29NO3Si/c1-22(2,3)27(18-11-7-5-8-12-18,19-13-9-6-10-14-19)26-17-15-20(24)23-21(16-17)25-4/h5-14,17,21H,15-16H2,1-4H3,(H,23,24)/t17-,21+/m1/s1.
What are the key properties of (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one?
(4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one has a molecular weight of 383.56 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,6S)-4-[tert-butyl(diphenyl)silyl]oxy-6-methoxypiperidin-2-one is sourced from PubChem (CID 11383512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).