[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol

C14H30O4Si — CID 10891600

IUPAC[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
SMILESCO[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)OC[C@@H]1C
InChIInChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3/t10-,11-,12-,13-/m0/s1
InChIKeyYBKKNJZOTAHCLV-CYDGBPFRSA-N
MW290.48 g/mol
LogP2.42
Rot. Bonds4

About [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol

[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol (PubChem CID 10891600) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
PubChem CID10891600
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Name[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol
SMILESCO[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)OC[C@@H]1C
InChIInChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3/t10-,11-,12-,13-/m0/s1
InChIKeyYBKKNJZOTAHCLV-CYDGBPFRSA-N
XLogP2.42
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol 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 [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The IUPAC name of [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol (CID 10891600) is [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol.
What is the SMILES notation for [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The canonical SMILES for [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol is CO[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)OC[C@@H]1C.
What is the InChIKey of [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
The InChIKey is YBKKNJZOTAHCLV-CYDGBPFRSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-10-9-17-11(8-15)13(12(10)16-5)18-19(6,7)14(2,3)4/h10-13,15H,8-9H2,1-7H3/t10-,11-,12-,13-/m0/s1.
What are the key properties of [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol?
[(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol has a molecular weight of 290.48 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-5-methyloxan-2-yl]methanol is sourced from PubChem (CID 10891600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).