trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate

C21H51NO5Si5 — CID 11353184

IUPACtrimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate
SMILESC[Si](C)(C)OC(=O)[C@@]1(O[Si](C)(C)C)CN([Si](C)(C)C)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C21H51NO5Si5/c1-28(2,3)22-16-18(24-29(4,5)6)19(25-30(7,8)9)21(17-22,27-32(13,14)15)20(23)26-31(10,11)12/h18-19H,16-17H2,1-15H3/t18-,19+,21-/m1/s1
InChIKeyOVZMTSAIVSAFGU-SVFBPWRDSA-N
MW538.07 g/mol
LogP5.55
Rot. Bonds9

About trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate

trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate (PubChem CID 11353184) has the molecular formula C21H51NO5Si5 and a molecular weight of 538.07 g/mol. Its IUPAC name is trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate.

Molecular Properties

Compound Nametrimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate
PubChem CID11353184
Molecular FormulaC21H51NO5Si5
Molecular Weight538.07 g/mol
Exact Mass537.26
IUPAC Nametrimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate
SMILESC[Si](C)(C)OC(=O)[C@@]1(O[Si](C)(C)C)CN([Si](C)(C)C)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C
InChIInChI=1S/C21H51NO5Si5/c1-28(2,3)22-16-18(24-29(4,5)6)19(25-30(7,8)9)21(17-22,27-32(13,14)15)20(23)26-31(10,11)12/h18-19H,16-17H2,1-15H3/t18-,19+,21-/m1/s1
InChIKeyOVZMTSAIVSAFGU-SVFBPWRDSA-N
XLogP5.55
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500538.07
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate?
The IUPAC name of trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate (CID 11353184) is trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate.
What is the SMILES notation for trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate?
The canonical SMILES for trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate is C[Si](C)(C)OC(=O)[C@@]1(O[Si](C)(C)C)CN([Si](C)(C)C)C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate?
The InChIKey is OVZMTSAIVSAFGU-SVFBPWRDSA-N. The full InChI is InChI=1S/C21H51NO5Si5/c1-28(2,3)22-16-18(24-29(4,5)6)19(25-30(7,8)9)21(17-22,27-32(13,14)15)20(23)26-31(10,11)12/h18-19H,16-17H2,1-15H3/t18-,19+,21-/m1/s1.
What are the key properties of trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate?
trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate has a molecular weight of 538.07 g/mol, XLogP of 5.55, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (3R,4S,5R)-1-trimethylsilyl-3,4,5-tris(trimethylsilyloxy)piperidine-3-carboxylate is sourced from PubChem (CID 11353184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).