1-adamantyl-dimethyl-pent-1-enylsilane

C17H30Si — CID 139918431

IUPAC1-adamantyl-dimethyl-pent-1-enylsilane
SMILESCCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H30Si/c1-4-5-6-7-18(2,3)17-11-14-8-15(12-17)10-16(9-14)13-17/h6-7,14-16H,4-5,8-13H2,1-3H3
InChIKeyAJWRFZOYQFWCLY-UHFFFAOYSA-N
MW262.51 g/mol
LogP5.56
Rot. Bonds4

About 1-adamantyl-dimethyl-pent-1-enylsilane

1-adamantyl-dimethyl-pent-1-enylsilane (PubChem CID 139918431) has the molecular formula C17H30Si and a molecular weight of 262.51 g/mol. Its IUPAC name is 1-adamantyl-dimethyl-pent-1-enylsilane.

Molecular Properties

Compound Name1-adamantyl-dimethyl-pent-1-enylsilane
PubChem CID139918431
Molecular FormulaC17H30Si
Molecular Weight262.51 g/mol
Exact Mass262.21
IUPAC Name1-adamantyl-dimethyl-pent-1-enylsilane
SMILESCCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C17H30Si/c1-4-5-6-7-18(2,3)17-11-14-8-15(12-17)10-16(9-14)13-17/h6-7,14-16H,4-5,8-13H2,1-3H3
InChIKeyAJWRFZOYQFWCLY-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.51
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-adamantyl-dimethyl-pent-1-enylsilane?
The IUPAC name of 1-adamantyl-dimethyl-pent-1-enylsilane (CID 139918431) is 1-adamantyl-dimethyl-pent-1-enylsilane.
What is the SMILES notation for 1-adamantyl-dimethyl-pent-1-enylsilane?
The canonical SMILES for 1-adamantyl-dimethyl-pent-1-enylsilane is CCCC=C[Si](C)(C)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-adamantyl-dimethyl-pent-1-enylsilane?
The InChIKey is AJWRFZOYQFWCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30Si/c1-4-5-6-7-18(2,3)17-11-14-8-15(12-17)10-16(9-14)13-17/h6-7,14-16H,4-5,8-13H2,1-3H3.
What are the key properties of 1-adamantyl-dimethyl-pent-1-enylsilane?
1-adamantyl-dimethyl-pent-1-enylsilane has a molecular weight of 262.51 g/mol, XLogP of 5.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-adamantyl-dimethyl-pent-1-enylsilane is sourced from PubChem (CID 139918431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).