(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol

C15H30O4Si — CID 172642176

IUPAC(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol
SMILESCC(C)[Si](O[C@H]1C=COC(CO)[C@H]1O)(C(C)C)C(C)C
InChIInChI=1S/C15H30O4Si/c1-10(2)20(11(3)4,12(5)6)19-13-7-8-18-14(9-16)15(13)17/h7-8,10-17H,9H2,1-6H3/t13-,14?,15-/m0/s1
InChIKeyGFDYPSSMYRYKRQ-LWEDLAQUSA-N
MW302.49 g/mol
LogP2.81
Rot. Bonds6

About (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol

(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol (PubChem CID 172642176) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol.

Molecular Properties

Compound Name(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol
PubChem CID172642176
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Name(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol
SMILESCC(C)[Si](O[C@H]1C=COC(CO)[C@H]1O)(C(C)C)C(C)C
InChIInChI=1S/C15H30O4Si/c1-10(2)20(11(3)4,12(5)6)19-13-7-8-18-14(9-16)15(13)17/h7-8,10-17H,9H2,1-6H3/t13-,14?,15-/m0/s1
InChIKeyGFDYPSSMYRYKRQ-LWEDLAQUSA-N
XLogP2.81
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol with MolForge

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

Launch Full Analysis

Related Compounds

tri(propan-2-yl)-[[(2R,3R,4R)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane
CID 11181065
tri(propan-2-yl)-[[(2R,3S,4S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane
CID 101106919
(2R,3S,4S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-ol
CID 25139138
(3S,4R)-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3,4-diol;methane
CID 159753385
(2R,3R)-4,4-difluoro-2-(hydroxymethyl)-5-tri(propan-2-yl)silyloxyoxolan-3-ol
CID 71602128
(2R)-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol
CID 163959935
[(4aR,8R,8aR)-2,2-dimethyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy-tri(propan-2-yl)silane
CID 11462014
(2R,3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-4-ol
CID 22859287
trimethyl-[[(2R,3S)-3-trimethylsilyloxy-2,3-dihydrofuran-2-yl]methoxy]silane
CID 11129066
[2-(hydroxymethyl)-3-methyl-3,4-dihydro-2H-pyran-4-yl] 2-ethylbutanoate
CID 121445159
(1S,2S,5S,6S,7R)-2,5,7-trimethyl-6-tri(propan-2-yl)silyloxycyclohept-3-en-1-ol
CID 11255876
2-[[(2R,3R,4R)-3-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-4-yl]oxymethyl]phthalazin-1-one
CID 177378145

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol?
The IUPAC name of (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol (CID 172642176) is (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol.
What is the SMILES notation for (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol?
The canonical SMILES for (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol is CC(C)[Si](O[C@H]1C=COC(CO)[C@H]1O)(C(C)C)C(C)C.
What is the InChIKey of (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol?
The InChIKey is GFDYPSSMYRYKRQ-LWEDLAQUSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-10(2)20(11(3)4,12(5)6)19-13-7-8-18-14(9-16)15(13)17/h7-8,10-17H,9H2,1-6H3/t13-,14?,15-/m0/s1.
What are the key properties of (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol?
(3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol has a molecular weight of 302.49 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-2-(hydroxymethyl)-4-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-3-ol is sourced from PubChem (CID 172642176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).