cyclohexylmethyl-dimethoxy-propan-2-ylsilane

C12H26O2Si — CID 18413008

IUPACcyclohexylmethyl-dimethoxy-propan-2-ylsilane
SMILESCO[Si](CC1CCCCC1)(OC)C(C)C
InChIInChI=1S/C12H26O2Si/c1-11(2)15(13-3,14-4)10-12-8-6-5-7-9-12/h11-12H,5-10H2,1-4H3
InChIKeyPXMJCGDAVLSZPM-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.71
Rot. Bonds5

About cyclohexylmethyl-dimethoxy-propan-2-ylsilane

cyclohexylmethyl-dimethoxy-propan-2-ylsilane (PubChem CID 18413008) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is cyclohexylmethyl-dimethoxy-propan-2-ylsilane.

Molecular Properties

Compound Namecyclohexylmethyl-dimethoxy-propan-2-ylsilane
PubChem CID18413008
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Namecyclohexylmethyl-dimethoxy-propan-2-ylsilane
SMILESCO[Si](CC1CCCCC1)(OC)C(C)C
InChIInChI=1S/C12H26O2Si/c1-11(2)15(13-3,14-4)10-12-8-6-5-7-9-12/h11-12H,5-10H2,1-4H3
InChIKeyPXMJCGDAVLSZPM-UHFFFAOYSA-N
XLogP3.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cyclohexylmethyl-dimethoxy-propan-2-ylsilane 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 cyclohexylmethyl-dimethoxy-propan-2-ylsilane?
The IUPAC name of cyclohexylmethyl-dimethoxy-propan-2-ylsilane (CID 18413008) is cyclohexylmethyl-dimethoxy-propan-2-ylsilane.
What is the SMILES notation for cyclohexylmethyl-dimethoxy-propan-2-ylsilane?
The canonical SMILES for cyclohexylmethyl-dimethoxy-propan-2-ylsilane is CO[Si](CC1CCCCC1)(OC)C(C)C.
What is the InChIKey of cyclohexylmethyl-dimethoxy-propan-2-ylsilane?
The InChIKey is PXMJCGDAVLSZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-11(2)15(13-3,14-4)10-12-8-6-5-7-9-12/h11-12H,5-10H2,1-4H3.
What are the key properties of cyclohexylmethyl-dimethoxy-propan-2-ylsilane?
cyclohexylmethyl-dimethoxy-propan-2-ylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl-dimethoxy-propan-2-ylsilane is sourced from PubChem (CID 18413008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).