(4-but-2-enylpiperazin-1-yl)-triethylsilane

C14H30N2Si — CID 68900092

IUPAC(4-but-2-enylpiperazin-1-yl)-triethylsilane
SMILESCC=CCN1CCN([Si](CC)(CC)CC)CC1
InChIInChI=1S/C14H30N2Si/c1-5-9-10-15-11-13-16(14-12-15)17(6-2,7-3)8-4/h5,9H,6-8,10-14H2,1-4H3
InChIKeyGYCRHLVYNUEUBK-UHFFFAOYSA-N
MW254.49 g/mol
LogP3.19
Rot. Bonds6

About (4-but-2-enylpiperazin-1-yl)-triethylsilane

(4-but-2-enylpiperazin-1-yl)-triethylsilane (PubChem CID 68900092) has the molecular formula C14H30N2Si and a molecular weight of 254.49 g/mol. Its IUPAC name is (4-but-2-enylpiperazin-1-yl)-triethylsilane.

Molecular Properties

Compound Name(4-but-2-enylpiperazin-1-yl)-triethylsilane
PubChem CID68900092
Molecular FormulaC14H30N2Si
Molecular Weight254.49 g/mol
Exact Mass254.22
IUPAC Name(4-but-2-enylpiperazin-1-yl)-triethylsilane
SMILESCC=CCN1CCN([Si](CC)(CC)CC)CC1
InChIInChI=1S/C14H30N2Si/c1-5-9-10-15-11-13-16(14-12-15)17(6-2,7-3)8-4/h5,9H,6-8,10-14H2,1-4H3
InChIKeyGYCRHLVYNUEUBK-UHFFFAOYSA-N
XLogP3.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.49
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (4-but-2-enylpiperazin-1-yl)-triethylsilane?
The IUPAC name of (4-but-2-enylpiperazin-1-yl)-triethylsilane (CID 68900092) is (4-but-2-enylpiperazin-1-yl)-triethylsilane.
What is the SMILES notation for (4-but-2-enylpiperazin-1-yl)-triethylsilane?
The canonical SMILES for (4-but-2-enylpiperazin-1-yl)-triethylsilane is CC=CCN1CCN([Si](CC)(CC)CC)CC1.
What is the InChIKey of (4-but-2-enylpiperazin-1-yl)-triethylsilane?
The InChIKey is GYCRHLVYNUEUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2Si/c1-5-9-10-15-11-13-16(14-12-15)17(6-2,7-3)8-4/h5,9H,6-8,10-14H2,1-4H3.
What are the key properties of (4-but-2-enylpiperazin-1-yl)-triethylsilane?
(4-but-2-enylpiperazin-1-yl)-triethylsilane has a molecular weight of 254.49 g/mol, XLogP of 3.19, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-but-2-enylpiperazin-1-yl)-triethylsilane is sourced from PubChem (CID 68900092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).