1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol

C14H31IOSi2 — CID 10501047

IUPAC1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol
SMILESC[Si](C)(C)C(I)(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H31IOSi2/c1-17(2,3)14(15,18(4,5)6)13(16)12-10-8-7-9-11-12/h12-13,16H,7-11H2,1-6H3
InChIKeyUCYOSGNPTYSESL-UHFFFAOYSA-N
MW398.48 g/mol
LogP4.86
Rot. Bonds4

About 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol

1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol (PubChem CID 10501047) has the molecular formula C14H31IOSi2 and a molecular weight of 398.48 g/mol. Its IUPAC name is 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol
PubChem CID10501047
Molecular FormulaC14H31IOSi2
Molecular Weight398.48 g/mol
Exact Mass398.10
IUPAC Name1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol
SMILESC[Si](C)(C)C(I)(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H31IOSi2/c1-17(2,3)14(15,18(4,5)6)13(16)12-10-8-7-9-11-12/h12-13,16H,7-11H2,1-6H3
InChIKeyUCYOSGNPTYSESL-UHFFFAOYSA-N
XLogP4.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.48
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol 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

1-cyclohexyl-2-(dimethylamino)-2-methylpropan-1-ol
CID 79046048
2-bromo-1-cyclohexyl-2,2-difluoroethanol
CID 107140105
1-cyclohexyl-2-cyclopentylethane-1,2-diol
CID 103459295
1-cycloheptyl-2-methyl-2-pyrrolidin-1-ylpropan-1-ol
CID 82932578
(1S)-1-cyclopentyl-2-trimethylsilylethanol;sulfane
CID 159518116
1-cyclohexyl-2-(dimethylamino)-2-methylbutan-1-ol
CID 79064519
1-cyclohexyl-2,2,3,3,4,4,4-heptafluorobutan-1-ol
CID 154329934
3-cyclododecylbutan-2-ol
CID 10444334
1-cycloheptylpropane-1,2-diol
CID 103452573
di(cyclohexadecyl)methylcyclohexadecane
CID 175406938
2-(aminomethyl)-1-cycloheptyl-2-methylbutan-1-ol
CID 79126284
3-cyclohexyl-2,2-difluoro-3-hydroxypropanoate
CID 164746791

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol?
The IUPAC name of 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol (CID 10501047) is 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol.
What is the SMILES notation for 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol?
The canonical SMILES for 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol is C[Si](C)(C)C(I)(C(O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol?
The InChIKey is UCYOSGNPTYSESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31IOSi2/c1-17(2,3)14(15,18(4,5)6)13(16)12-10-8-7-9-11-12/h12-13,16H,7-11H2,1-6H3.
What are the key properties of 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol?
1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol has a molecular weight of 398.48 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-iodo-2,2-bis(trimethylsilyl)ethanol is sourced from PubChem (CID 10501047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).