[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane

C16H34O2Si — CID 123471868

IUPAC[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane
SMILESC[SiH2]C(OCC(C)C)(OCC(C)C)C1CCCCC1
InChIInChI=1S/C16H34O2Si/c1-13(2)11-17-16(19-5,18-12-14(3)4)15-9-7-6-8-10-15/h13-15H,6-12,19H2,1-5H3
InChIKeyLTZWPHFEKHFWAT-UHFFFAOYSA-N
MW286.53 g/mol
LogP3.78
Rot. Bonds8

About [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane

[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane (PubChem CID 123471868) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane.

Molecular Properties

Compound Name[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane
PubChem CID123471868
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane
SMILESC[SiH2]C(OCC(C)C)(OCC(C)C)C1CCCCC1
InChIInChI=1S/C16H34O2Si/c1-13(2)11-17-16(19-5,18-12-14(3)4)15-9-7-6-8-10-15/h13-15H,6-12,19H2,1-5H3
InChIKeyLTZWPHFEKHFWAT-UHFFFAOYSA-N
XLogP3.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.53
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane?
The IUPAC name of [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane (CID 123471868) is [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane.
What is the SMILES notation for [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane?
The canonical SMILES for [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane is C[SiH2]C(OCC(C)C)(OCC(C)C)C1CCCCC1.
What is the InChIKey of [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane?
The InChIKey is LTZWPHFEKHFWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-13(2)11-17-16(19-5,18-12-14(3)4)15-9-7-6-8-10-15/h13-15H,6-12,19H2,1-5H3.
What are the key properties of [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane?
[cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane has a molecular weight of 286.53 g/mol, XLogP of 3.78, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane is sourced from PubChem (CID 123471868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).