2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol

C15H32OSi — CID 154711087

IUPAC2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol
SMILESCCCC[Si](C)(C)[C@@H]1CCCC[C@H]1C(C)(C)O
InChIInChI=1S/C15H32OSi/c1-6-7-12-17(4,5)14-11-9-8-10-13(14)15(2,3)16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1
InChIKeyCQRAJMOPABGBDL-ZIAGYGMSSA-N
MW256.51 g/mol
LogP4.83
Rot. Bonds5

About 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol

2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol (PubChem CID 154711087) has the molecular formula C15H32OSi and a molecular weight of 256.51 g/mol. Its IUPAC name is 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol.

Molecular Properties

Compound Name2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol
PubChem CID154711087
Molecular FormulaC15H32OSi
Molecular Weight256.51 g/mol
Exact Mass256.22
IUPAC Name2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol
SMILESCCCC[Si](C)(C)[C@@H]1CCCC[C@H]1C(C)(C)O
InChIInChI=1S/C15H32OSi/c1-6-7-12-17(4,5)14-11-9-8-10-13(14)15(2,3)16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1
InChIKeyCQRAJMOPABGBDL-ZIAGYGMSSA-N
XLogP4.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.51
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Cyclohexanemethanol, alpha,alpha-dimethyl-
CID 85531
2-Cyclohexyl-hexan-2-ol
CID 568244
3-Cyclohexyl-2-methylbutan-2-ol
CID 20443431
4-Cyclohexyl-2-methylpentan-2-ol
CID 67400066
Isopropyl cyclohexyl propanol
CID 60921357
1-Trimethylsilylmethylcyclohexanol
CID 4128986
cis-(1S,3S)-1-methyl-3-trimethylsilylcyclohexan-1-ol
CID 11074122
1-(2'-s-Octyl)cyclohexanol
CID 12721355
1-(2-Trimethylsilylethyl)cyclohexan-1-ol
CID 12937314
cis-(1R,2R)-2-methyl-1-trimethylsilylcyclohexan-1-ol
CID 13024088
4-Tert-butyl-1-(trimethylsilylmethyl)cyclohexan-1-ol
CID 13699766
(2S,3R)-2-cyclohexyl-3-trimethylsilylheptan-3-ol
CID 14087111

Frequently Asked Questions

What is the IUPAC name of 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol?
The IUPAC name of 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol (CID 154711087) is 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol.
What is the SMILES notation for 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol?
The canonical SMILES for 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol is CCCC[Si](C)(C)[C@@H]1CCCC[C@H]1C(C)(C)O.
What is the InChIKey of 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol?
The InChIKey is CQRAJMOPABGBDL-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H32OSi/c1-6-7-12-17(4,5)14-11-9-8-10-13(14)15(2,3)16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1.
What are the key properties of 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol?
2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol has a molecular weight of 256.51 g/mol, XLogP of 4.83, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S,2R)-2-[butyl(dimethyl)silyl]cyclohexyl]propan-2-ol is sourced from PubChem (CID 154711087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).