tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane

C11H25IOSi — CID 11023920

IUPACtert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane
SMILESCC(CCCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25IOSi/c1-10(8-7-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3
InChIKeyOMQJPDWPFDDARI-UHFFFAOYSA-N
MW328.31 g/mol
LogP4.61
Rot. Bonds5

About tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane

tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane (PubChem CID 11023920) has the molecular formula C11H25IOSi and a molecular weight of 328.31 g/mol. Its IUPAC name is tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane
PubChem CID11023920
Molecular FormulaC11H25IOSi
Molecular Weight328.31 g/mol
Exact Mass328.07
IUPAC Nametert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane
SMILESCC(CCCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25IOSi/c1-10(8-7-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3
InChIKeyOMQJPDWPFDDARI-UHFFFAOYSA-N
XLogP4.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.31
LogP ≤ 54.61
H-Bond Donors ≤ 50
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 tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane 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 tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane?
The IUPAC name of tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane (CID 11023920) is tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane is CC(CCCI)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane?
The InChIKey is OMQJPDWPFDDARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25IOSi/c1-10(8-7-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3.
What are the key properties of tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane?
tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane has a molecular weight of 328.31 g/mol, XLogP of 4.61, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(5-iodopentan-2-yloxy)-dimethylsilane is sourced from PubChem (CID 11023920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).