2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane

C14H26Si — CID 22228914

IUPAC2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane
SMILESCC(C)C[Si](C)(C)CC1CC2C=CC1C2
InChIInChI=1S/C14H26Si/c1-11(2)9-15(3,4)10-14-8-12-5-6-13(14)7-12/h5-6,11-14H,7-10H2,1-4H3
InChIKeyNKXUYYZHQVBQOS-UHFFFAOYSA-N
MW222.45 g/mol
LogP4.56
Rot. Bonds4

About 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane

2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane (PubChem CID 22228914) has the molecular formula C14H26Si and a molecular weight of 222.45 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane
PubChem CID22228914
Molecular FormulaC14H26Si
Molecular Weight222.45 g/mol
Exact Mass222.18
IUPAC Name2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane
SMILESCC(C)C[Si](C)(C)CC1CC2C=CC1C2
InChIInChI=1S/C14H26Si/c1-11(2)9-15(3,4)10-14-8-12-5-6-13(14)7-12/h5-6,11-14H,7-10H2,1-4H3
InChIKeyNKXUYYZHQVBQOS-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.45
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane (CID 22228914) is 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane is CC(C)C[Si](C)(C)CC1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane?
The InChIKey is NKXUYYZHQVBQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26Si/c1-11(2)9-15(3,4)10-14-8-12-5-6-13(14)7-12/h5-6,11-14H,7-10H2,1-4H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane?
2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane has a molecular weight of 222.45 g/mol, XLogP of 4.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-(2-methylpropyl)silane is sourced from PubChem (CID 22228914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).