[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol

C12H26O2Si — CID 170904797

IUPAC[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CCC[C@@H]1CO
InChIInChI=1S/C12H26O2Si/c1-12(2,3)15(4,5)14-11-8-6-7-10(11)9-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m1/s1
InChIKeyQRELYVHEPVDASS-MNOVXSKESA-N
MW230.42 g/mol
LogP3.17
Rot. Bonds3

About [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol

[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol (PubChem CID 170904797) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol.

Molecular Properties

Compound Name[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol
PubChem CID170904797
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol
SMILESCC(C)(C)[Si](C)(C)O[C@H]1CCC[C@@H]1CO
InChIInChI=1S/C12H26O2Si/c1-12(2,3)15(4,5)14-11-8-6-7-10(11)9-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m1/s1
InChIKeyQRELYVHEPVDASS-MNOVXSKESA-N
XLogP3.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(1R,2R)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol
CID 170904845
3-[2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]propan-1-ol
CID 70178632
[(1R,2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopentyl]methanol
CID 67782499
tert-butyl-[(1S,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-dimethylsilane;tert-butyl-[(1R,2R)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-dimethylsilane
CID 158464609
[(1S,2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-(sulfinomethyl)cyclohexyl]methanesulfinic acid
CID 172731654
tert-butyl (3R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-3-(hydroxymethyl)piperidine-1-carboxylate
CID 129407130
[(2R,3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-tritiooxolan-2-yl]methanol
CID 138965172
[(4R)-4-[tert-butyl(dimethyl)silyl]oxy-8,8-dimethyl-6-bicyclo[3.2.1]octanyl]methanol
CID 101226525
[(1R,4R,6S,7R,10R,11S)-10-[tert-butyl(dimethyl)silyl]oxy-6-tricyclo[5.3.2.04,11]dodecanyl]methanol
CID 53348300
tert-butyl-dimethyl-[(1S,2S)-2-(1-trimethylsilylethenyl)cyclopentyl]oxysilane
CID 102254534
(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-ol
CID 129404592
[(1S,2S,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 174057960

Frequently Asked Questions

What is the IUPAC name of [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol?
The IUPAC name of [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol (CID 170904797) is [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol.
What is the SMILES notation for [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol?
The canonical SMILES for [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol is CC(C)(C)[Si](C)(C)O[C@H]1CCC[C@@H]1CO.
What is the InChIKey of [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol?
The InChIKey is QRELYVHEPVDASS-MNOVXSKESA-N. The full InChI is InChI=1S/C12H26O2Si/c1-12(2,3)15(4,5)14-11-8-6-7-10(11)9-13/h10-11,13H,6-9H2,1-5H3/t10-,11+/m1/s1.
What are the key properties of [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol?
[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol has a molecular weight of 230.42 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclopentyl]methanol is sourced from PubChem (CID 170904797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).