tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane

C12H26N2Si — CID 23150047

IUPACtert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane
SMILESC=CN1CCN([Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C12H26N2Si/c1-7-13-8-10-14(11-9-13)15(5,6)12(2,3)4/h7H,1,8-11H2,2-6H3
InChIKeyCYAQVHLMFIKTOK-UHFFFAOYSA-N
MW226.44 g/mol
LogP2.75
Rot. Bonds2

About tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane

tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane (PubChem CID 23150047) has the molecular formula C12H26N2Si and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane
PubChem CID23150047
Molecular FormulaC12H26N2Si
Molecular Weight226.44 g/mol
Exact Mass226.19
IUPAC Nametert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane
SMILESC=CN1CCN([Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C12H26N2Si/c1-7-13-8-10-14(11-9-13)15(5,6)12(2,3)4/h7H,1,8-11H2,2-6H3
InChIKeyCYAQVHLMFIKTOK-UHFFFAOYSA-N
XLogP2.75
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane?
The IUPAC name of tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane (CID 23150047) is tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane.
What is the SMILES notation for tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane?
The canonical SMILES for tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane is C=CN1CCN([Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane?
The InChIKey is CYAQVHLMFIKTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2Si/c1-7-13-8-10-14(11-9-13)15(5,6)12(2,3)4/h7H,1,8-11H2,2-6H3.
What are the key properties of tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane?
tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(4-ethenylpiperazin-1-yl)-dimethylsilane is sourced from PubChem (CID 23150047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).