2-methyl-5-triethylsilyloxyadamantan-2-ol

C17H32O2Si — CID 140785194

IUPAC2-methyl-5-triethylsilyloxyadamantan-2-ol
SMILESCC[Si](CC)(CC)OC12CC3CC(C1)C(C)(O)C(C3)C2
InChIInChI=1S/C17H32O2Si/c1-5-20(6-2,7-3)19-17-10-13-8-14(11-17)16(4,18)15(9-13)12-17/h13-15,18H,5-12H2,1-4H3
InChIKeyNIJHTYHLKHXFRI-UHFFFAOYSA-N
MW296.53 g/mol
LogP4.34
Rot. Bonds5

About 2-methyl-5-triethylsilyloxyadamantan-2-ol

2-methyl-5-triethylsilyloxyadamantan-2-ol (PubChem CID 140785194) has the molecular formula C17H32O2Si and a molecular weight of 296.53 g/mol. Its IUPAC name is 2-methyl-5-triethylsilyloxyadamantan-2-ol.

Molecular Properties

Compound Name2-methyl-5-triethylsilyloxyadamantan-2-ol
PubChem CID140785194
Molecular FormulaC17H32O2Si
Molecular Weight296.53 g/mol
Exact Mass296.22
IUPAC Name2-methyl-5-triethylsilyloxyadamantan-2-ol
SMILESCC[Si](CC)(CC)OC12CC3CC(C1)C(C)(O)C(C3)C2
InChIInChI=1S/C17H32O2Si/c1-5-20(6-2,7-3)19-17-10-13-8-14(11-17)16(4,18)15(9-13)12-17/h13-15,18H,5-12H2,1-4H3
InChIKeyNIJHTYHLKHXFRI-UHFFFAOYSA-N
XLogP4.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.53
LogP ≤ 54.34
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

1-(4-hydroxy-4-methyl-1-adamantyl)ethanone
CID 122499390
3-methyl-3-triethylsilyloxycyclobutane-1-carbonitrile
CID 177439553
1-adamantyl 2-ethyladamantane-2-carboxylate
CID 166021559
2,2-diethyladamantan-1-ol
CID 22670607
[5-(2-hydroxyethoxy)-2-methyl-2-adamantyl] 2,2-dimethylbutanoate
CID 159024762
4-propyladamantane-1,4-diol
CID 139814586
4-ethenyl-4-methyladamantan-1-ol
CID 134192895
(3-hydroxy-1-tricyclo[3.3.1.03,7]nonanyl) 2-methylbutanoate
CID 148916900
4-(methoxymethoxy)-4-methyladamantan-1-ol
CID 156622050
[4-hydroxy-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1-adamantyl] 2,2-dimethylbutanoate
CID 71176494
(1S,4R)-2-methylbicyclo[2.2.1]heptan-2-ol
CID 134981260
1-methoxyadamantane
CID 584854

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-triethylsilyloxyadamantan-2-ol?
The IUPAC name of 2-methyl-5-triethylsilyloxyadamantan-2-ol (CID 140785194) is 2-methyl-5-triethylsilyloxyadamantan-2-ol.
What is the SMILES notation for 2-methyl-5-triethylsilyloxyadamantan-2-ol?
The canonical SMILES for 2-methyl-5-triethylsilyloxyadamantan-2-ol is CC[Si](CC)(CC)OC12CC3CC(C1)C(C)(O)C(C3)C2.
What is the InChIKey of 2-methyl-5-triethylsilyloxyadamantan-2-ol?
The InChIKey is NIJHTYHLKHXFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2Si/c1-5-20(6-2,7-3)19-17-10-13-8-14(11-17)16(4,18)15(9-13)12-17/h13-15,18H,5-12H2,1-4H3.
What are the key properties of 2-methyl-5-triethylsilyloxyadamantan-2-ol?
2-methyl-5-triethylsilyloxyadamantan-2-ol has a molecular weight of 296.53 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-triethylsilyloxyadamantan-2-ol is sourced from PubChem (CID 140785194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).