[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane

C12H25NSi — CID 67433286

IUPAC[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane
SMILESC/C=C/C[Si](C)(C)CN1CCCCC1
InChIInChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-13-9-7-6-8-10-13/h4-5H,6-12H2,1-3H3/b5-4+
InChIKeyXQLJNBCZRIRQEO-SNAWJCMRSA-N
MW211.43 g/mol
LogP3.30
Rot. Bonds4

About [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane

[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane (PubChem CID 67433286) has the molecular formula C12H25NSi and a molecular weight of 211.43 g/mol. Its IUPAC name is [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane.

Molecular Properties

Compound Name[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane
PubChem CID67433286
Molecular FormulaC12H25NSi
Molecular Weight211.43 g/mol
Exact Mass211.18
IUPAC Name[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane
SMILESC/C=C/C[Si](C)(C)CN1CCCCC1
InChIInChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-13-9-7-6-8-10-13/h4-5H,6-12H2,1-3H3/b5-4+
InChIKeyXQLJNBCZRIRQEO-SNAWJCMRSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.43
LogP ≤ 53.30
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 [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane?
The IUPAC name of [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane (CID 67433286) is [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane.
What is the SMILES notation for [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane?
The canonical SMILES for [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane is C/C=C/C[Si](C)(C)CN1CCCCC1.
What is the InChIKey of [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane?
The InChIKey is XQLJNBCZRIRQEO-SNAWJCMRSA-N. The full InChI is InChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-13-9-7-6-8-10-13/h4-5H,6-12H2,1-3H3/b5-4+.
What are the key properties of [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane?
[(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane has a molecular weight of 211.43 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-but-2-enyl]-dimethyl-(piperidin-1-ylmethyl)silane is sourced from PubChem (CID 67433286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).