but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane

C12H25NSi — CID 67431435

IUPACbut-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane
SMILESCC=CC[Si](C)(C)CCN1CCCC1
InChIInChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-10-13-8-6-7-9-13/h4-5H,6-12H2,1-3H3
InChIKeyWSBXRPBDSOXGFA-UHFFFAOYSA-N
MW211.43 g/mol
LogP3.37
Rot. Bonds5

About but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane

but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane (PubChem CID 67431435) has the molecular formula C12H25NSi and a molecular weight of 211.43 g/mol. Its IUPAC name is but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane.

Molecular Properties

Compound Namebut-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane
PubChem CID67431435
Molecular FormulaC12H25NSi
Molecular Weight211.43 g/mol
Exact Mass211.18
IUPAC Namebut-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane
SMILESCC=CC[Si](C)(C)CCN1CCCC1
InChIInChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-10-13-8-6-7-9-13/h4-5H,6-12H2,1-3H3
InChIKeyWSBXRPBDSOXGFA-UHFFFAOYSA-N
XLogP3.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.43
LogP ≤ 53.37
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 but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane?
The IUPAC name of but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane (CID 67431435) is but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane.
What is the SMILES notation for but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane?
The canonical SMILES for but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane is CC=CC[Si](C)(C)CCN1CCCC1.
What is the InChIKey of but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane?
The InChIKey is WSBXRPBDSOXGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NSi/c1-4-5-11-14(2,3)12-10-13-8-6-7-9-13/h4-5H,6-12H2,1-3H3.
What are the key properties of but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane?
but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane has a molecular weight of 211.43 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enyl-dimethyl-(2-pyrrolidin-1-ylethyl)silane is sourced from PubChem (CID 67431435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).