1-iodopentoxysilane

C5H13IOSi — CID 173081223

IUPAC1-iodopentoxysilane
SMILESCCCCC(I)O[SiH3]
InChIInChI=1S/C5H13IOSi/c1-2-3-4-5(6)7-8/h5H,2-4H2,1,8H3
InChIKeyFBLVKMMAUMYPPA-UHFFFAOYSA-N
MW244.15 g/mol
LogP1.23
Rot. Bonds4

About 1-iodopentoxysilane

1-iodopentoxysilane (PubChem CID 173081223) has the molecular formula C5H13IOSi and a molecular weight of 244.15 g/mol. Its IUPAC name is 1-iodopentoxysilane.

Molecular Properties

Compound Name1-iodopentoxysilane
PubChem CID173081223
Molecular FormulaC5H13IOSi
Molecular Weight244.15 g/mol
Exact Mass243.98
IUPAC Name1-iodopentoxysilane
SMILESCCCCC(I)O[SiH3]
InChIInChI=1S/C5H13IOSi/c1-2-3-4-5(6)7-8/h5H,2-4H2,1,8H3
InChIKeyFBLVKMMAUMYPPA-UHFFFAOYSA-N
XLogP1.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.15
LogP ≤ 51.23
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'}

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Frequently Asked Questions

What is the IUPAC name of 1-iodopentoxysilane?
The IUPAC name of 1-iodopentoxysilane (CID 173081223) is 1-iodopentoxysilane.
What is the SMILES notation for 1-iodopentoxysilane?
The canonical SMILES for 1-iodopentoxysilane is CCCCC(I)O[SiH3].
What is the InChIKey of 1-iodopentoxysilane?
The InChIKey is FBLVKMMAUMYPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13IOSi/c1-2-3-4-5(6)7-8/h5H,2-4H2,1,8H3.
What are the key properties of 1-iodopentoxysilane?
1-iodopentoxysilane has a molecular weight of 244.15 g/mol, XLogP of 1.23, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodopentoxysilane is sourced from PubChem (CID 173081223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).