6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one

C16H30O4Si2 — CID 15164074

IUPAC6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one
SMILESC[Si](C)(C)OC1=CCC(C2(O[Si](C)(C)C)CCCC2)C(=O)O1
InChIInChI=1S/C16H30O4Si2/c1-21(2,3)19-14-10-9-13(15(17)18-14)16(11-7-8-12-16)20-22(4,5)6/h10,13H,7-9,11-12H2,1-6H3
InChIKeyLGQXLSOYTQEJLU-UHFFFAOYSA-N
MW342.58 g/mol
LogP4.41
Rot. Bonds5

About 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one

6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one (PubChem CID 15164074) has the molecular formula C16H30O4Si2 and a molecular weight of 342.58 g/mol. Its IUPAC name is 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one.

Molecular Properties

Compound Name6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one
PubChem CID15164074
Molecular FormulaC16H30O4Si2
Molecular Weight342.58 g/mol
Exact Mass342.17
IUPAC Name6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one
SMILESC[Si](C)(C)OC1=CCC(C2(O[Si](C)(C)C)CCCC2)C(=O)O1
InChIInChI=1S/C16H30O4Si2/c1-21(2,3)19-14-10-9-13(15(17)18-14)16(11-7-8-12-16)20-22(4,5)6/h10,13H,7-9,11-12H2,1-6H3
InChIKeyLGQXLSOYTQEJLU-UHFFFAOYSA-N
XLogP4.41
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.58
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one 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 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one?
The IUPAC name of 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one (CID 15164074) is 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one.
What is the SMILES notation for 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one?
The canonical SMILES for 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one is C[Si](C)(C)OC1=CCC(C2(O[Si](C)(C)C)CCCC2)C(=O)O1.
What is the InChIKey of 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one?
The InChIKey is LGQXLSOYTQEJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O4Si2/c1-21(2,3)19-14-10-9-13(15(17)18-14)16(11-7-8-12-16)20-22(4,5)6/h10,13H,7-9,11-12H2,1-6H3.
What are the key properties of 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one?
6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one has a molecular weight of 342.58 g/mol, XLogP of 4.41, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-trimethylsilyloxy-3-(1-trimethylsilyloxycyclopentyl)-3,4-dihydropyran-2-one is sourced from PubChem (CID 15164074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).