(1-but-3-enylpiperidin-2-yl)-trimethylsilane

C12H25NSi — CID 138968084

IUPAC(1-but-3-enylpiperidin-2-yl)-trimethylsilane
SMILESC=CCCN1CCCCC1[Si](C)(C)C
InChIInChI=1S/C12H25NSi/c1-5-6-10-13-11-8-7-9-12(13)14(2,3)4/h5,12H,1,6-11H2,2-4H3
InChIKeyJYKDUGRCJGFXJD-UHFFFAOYSA-N
MW211.42 g/mol
LogP3.29
Rot. Bonds4

About (1-but-3-enylpiperidin-2-yl)-trimethylsilane

(1-but-3-enylpiperidin-2-yl)-trimethylsilane (PubChem CID 138968084) has the molecular formula C12H25NSi and a molecular weight of 211.42 g/mol. Its IUPAC name is (1-but-3-enylpiperidin-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(1-but-3-enylpiperidin-2-yl)-trimethylsilane
PubChem CID138968084
Molecular FormulaC12H25NSi
Molecular Weight211.42 g/mol
Exact Mass211.18
IUPAC Name(1-but-3-enylpiperidin-2-yl)-trimethylsilane
SMILESC=CCCN1CCCCC1[Si](C)(C)C
InChIInChI=1S/C12H25NSi/c1-5-6-10-13-11-8-7-9-12(13)14(2,3)4/h5,12H,1,6-11H2,2-4H3
InChIKeyJYKDUGRCJGFXJD-UHFFFAOYSA-N
XLogP3.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.42
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (1-but-3-enylpiperidin-2-yl)-trimethylsilane?
The IUPAC name of (1-but-3-enylpiperidin-2-yl)-trimethylsilane (CID 138968084) is (1-but-3-enylpiperidin-2-yl)-trimethylsilane.
What is the SMILES notation for (1-but-3-enylpiperidin-2-yl)-trimethylsilane?
The canonical SMILES for (1-but-3-enylpiperidin-2-yl)-trimethylsilane is C=CCCN1CCCCC1[Si](C)(C)C.
What is the InChIKey of (1-but-3-enylpiperidin-2-yl)-trimethylsilane?
The InChIKey is JYKDUGRCJGFXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NSi/c1-5-6-10-13-11-8-7-9-12(13)14(2,3)4/h5,12H,1,6-11H2,2-4H3.
What are the key properties of (1-but-3-enylpiperidin-2-yl)-trimethylsilane?
(1-but-3-enylpiperidin-2-yl)-trimethylsilane has a molecular weight of 211.42 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-but-3-enylpiperidin-2-yl)-trimethylsilane is sourced from PubChem (CID 138968084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).