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

C13H27NSi — CID 67430256

IUPAC[(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane
SMILESC/C=C/C[Si](C)(C)CCN1CCCCC1
InChIInChI=1S/C13H27NSi/c1-4-5-12-15(2,3)13-11-14-9-7-6-8-10-14/h4-5H,6-13H2,1-3H3/b5-4+
InChIKeyCPQNPJCPWQDMQC-SNAWJCMRSA-N
MW225.45 g/mol
LogP3.76
Rot. Bonds5

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

[(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane (PubChem CID 67430256) has the molecular formula C13H27NSi and a molecular weight of 225.45 g/mol. Its IUPAC name is [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane.

Molecular Properties

Compound Name[(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane
PubChem CID67430256
Molecular FormulaC13H27NSi
Molecular Weight225.45 g/mol
Exact Mass225.19
IUPAC Name[(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane
SMILESC/C=C/C[Si](C)(C)CCN1CCCCC1
InChIInChI=1S/C13H27NSi/c1-4-5-12-15(2,3)13-11-14-9-7-6-8-10-14/h4-5H,6-13H2,1-3H3/b5-4+
InChIKeyCPQNPJCPWQDMQC-SNAWJCMRSA-N
XLogP3.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.45
LogP ≤ 53.76
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-(2-piperidin-1-ylethyl)silane?
The IUPAC name of [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane (CID 67430256) is [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane.
What is the SMILES notation for [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane?
The canonical SMILES for [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane is C/C=C/C[Si](C)(C)CCN1CCCCC1.
What is the InChIKey of [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane?
The InChIKey is CPQNPJCPWQDMQC-SNAWJCMRSA-N. The full InChI is InChI=1S/C13H27NSi/c1-4-5-12-15(2,3)13-11-14-9-7-6-8-10-14/h4-5H,6-13H2,1-3H3/b5-4+.
What are the key properties of [(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane?
[(E)-but-2-enyl]-dimethyl-(2-piperidin-1-ylethyl)silane has a molecular weight of 225.45 g/mol, XLogP of 3.76, 5 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-(2-piperidin-1-ylethyl)silane is sourced from PubChem (CID 67430256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).