[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane

C17H36N2Si — CID 23150119

IUPAC[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane
SMILESCC/C=C/N1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1
InChIInChI=1S/C17H36N2Si/c1-8-9-10-18-11-13-19(14-12-18)20(15(2)3,16(4)5)17(6)7/h9-10,15-17H,8,11-14H2,1-7H3/b10-9+
InChIKeyQMINIEGRHOOQAE-MDZDMXLPSA-N
MW296.57 g/mol
LogP4.70
Rot. Bonds6

About [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane

[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane (PubChem CID 23150119) has the molecular formula C17H36N2Si and a molecular weight of 296.57 g/mol. Its IUPAC name is [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane
PubChem CID23150119
Molecular FormulaC17H36N2Si
Molecular Weight296.57 g/mol
Exact Mass296.26
IUPAC Name[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane
SMILESCC/C=C/N1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1
InChIInChI=1S/C17H36N2Si/c1-8-9-10-18-11-13-19(14-12-18)20(15(2)3,16(4)5)17(6)7/h9-10,15-17H,8,11-14H2,1-7H3/b10-9+
InChIKeyQMINIEGRHOOQAE-MDZDMXLPSA-N
XLogP4.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.57
LogP ≤ 54.70
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 [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane?
The IUPAC name of [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane (CID 23150119) is [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane.
What is the SMILES notation for [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane?
The canonical SMILES for [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane is CC/C=C/N1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1.
What is the InChIKey of [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane?
The InChIKey is QMINIEGRHOOQAE-MDZDMXLPSA-N. The full InChI is InChI=1S/C17H36N2Si/c1-8-9-10-18-11-13-19(14-12-18)20(15(2)3,16(4)5)17(6)7/h9-10,15-17H,8,11-14H2,1-7H3/b10-9+.
What are the key properties of [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane?
[4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane has a molecular weight of 296.57 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(E)-but-1-enyl]piperazin-1-yl]-tri(propan-2-yl)silane is sourced from PubChem (CID 23150119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).