[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol

C18H38O3Si — CID 11688526

IUPAC[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol
SMILESCCC[C@](C)(C[C@H]1O[C@@H]1CO)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H38O3Si/c1-9-10-18(8,11-16-17(12-19)20-16)21-22(13(2)3,14(4)5)15(6)7/h13-17,19H,9-12H2,1-8H3/t16-,17-,18-/m1/s1
InChIKeyJPBLKOUSTGBHND-KZNAEPCWSA-N
MW330.59 g/mol
LogP4.89
Rot. Bonds10

About [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol

[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol (PubChem CID 11688526) has the molecular formula C18H38O3Si and a molecular weight of 330.59 g/mol. Its IUPAC name is [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol
PubChem CID11688526
Molecular FormulaC18H38O3Si
Molecular Weight330.59 g/mol
Exact Mass330.26
IUPAC Name[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol
SMILESCCC[C@](C)(C[C@H]1O[C@@H]1CO)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H38O3Si/c1-9-10-18(8,11-16-17(12-19)20-16)21-22(13(2)3,14(4)5)15(6)7/h13-17,19H,9-12H2,1-8H3/t16-,17-,18-/m1/s1
InChIKeyJPBLKOUSTGBHND-KZNAEPCWSA-N
XLogP4.89
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.59
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol with MolForge

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Launch Full Analysis

Related Compounds

(2S)-2-[(2R,5S)-5-[(1S)-2-[tert-butyl(dimethyl)silyl]oxy-1-hydroxyethyl]-5-methyloxolan-2-yl]propane-1,2-diol
CID 10404679
(2R,3R)-3-[(2R,3R)-3-methyloxiran-2-yl]-1-tri(propan-2-yl)silyloxybutan-2-ol
CID 11023066
(2R,3R)-3-[(2R,3S)-3-methyloxiran-2-yl]-1-tri(propan-2-yl)silyloxybutan-2-ol
CID 11358562
(2S)-2-[(2R,5S)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-2-hydroxyethyl]-5-methyloxolan-2-yl]propane-1,2-diol
CID 11724463
(2R,3S,7R,8S)-5-methyl-2,8-bis[tri(propan-2-yl)silyloxymethyl]oxocane-3,7-diol
CID 11731167
[(2R,3R)-3-[(2R,3R)-2,3-bis[[tert-butyl(dimethyl)silyl]oxy]butyl]oxiran-2-yl]methanol
CID 11811227
(2R,3S)-3-[(2R,3R)-3-methyloxiran-2-yl]-1-tri(propan-2-yl)silyloxybutan-2-ol
CID 12061955
3-(3-Methyloxiran-2-yl)-1-tri(propan-2-yl)silyloxybutan-2-ol
CID 14967405
(2R)-1-[(2R,3R)-3-(hydroxymethyl)oxiran-2-yl]-2-methylpentan-2-ol
CID 16220343
[(2S,3S)-3-[(2S,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylbutyl]oxiran-2-yl]methanol
CID 46933875
(2S,3R,6S,7R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-7-(hydroxymethyl)-2,7-dimethyloxepane-3,6-diol
CID 51050895
cis-(1S,2R)-2-[(2R)-2-hydroxy-3-tri(propan-2-yl)silyloxypropyl]-1-methylcyclopropan-1-ol
CID 102463956

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol?
The IUPAC name of [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol (CID 11688526) is [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol.
What is the SMILES notation for [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol?
The canonical SMILES for [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol is CCC[C@](C)(C[C@H]1O[C@@H]1CO)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol?
The InChIKey is JPBLKOUSTGBHND-KZNAEPCWSA-N. The full InChI is InChI=1S/C18H38O3Si/c1-9-10-18(8,11-16-17(12-19)20-16)21-22(13(2)3,14(4)5)15(6)7/h13-17,19H,9-12H2,1-8H3/t16-,17-,18-/m1/s1.
What are the key properties of [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol?
[(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol has a molecular weight of 330.59 g/mol, XLogP of 4.89, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-3-[(2R)-2-methyl-2-tri(propan-2-yl)silyloxypentyl]oxiran-2-yl]methanol is sourced from PubChem (CID 11688526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).