diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane

C14H29NSi — CID 87398255

IUPACdiethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane
SMILESCCC[Si](CC)(CC)CC=CN1CCCC1
InChIInChI=1S/C14H29NSi/c1-4-13-16(5-2,6-3)14-9-12-15-10-7-8-11-15/h9,12H,4-8,10-11,13-14H2,1-3H3
InChIKeyMFKJJDQWHYCBIX-UHFFFAOYSA-N
MW239.48 g/mol
LogP4.49
Rot. Bonds7

About diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane

diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane (PubChem CID 87398255) has the molecular formula C14H29NSi and a molecular weight of 239.48 g/mol. Its IUPAC name is diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane.

Molecular Properties

Compound Namediethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane
PubChem CID87398255
Molecular FormulaC14H29NSi
Molecular Weight239.48 g/mol
Exact Mass239.21
IUPAC Namediethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane
SMILESCCC[Si](CC)(CC)CC=CN1CCCC1
InChIInChI=1S/C14H29NSi/c1-4-13-16(5-2,6-3)14-9-12-15-10-7-8-11-15/h9,12H,4-8,10-11,13-14H2,1-3H3
InChIKeyMFKJJDQWHYCBIX-UHFFFAOYSA-N
XLogP4.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.48
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane?
The IUPAC name of diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane (CID 87398255) is diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane.
What is the SMILES notation for diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane?
The canonical SMILES for diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane is CCC[Si](CC)(CC)CC=CN1CCCC1.
What is the InChIKey of diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane?
The InChIKey is MFKJJDQWHYCBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NSi/c1-4-13-16(5-2,6-3)14-9-12-15-10-7-8-11-15/h9,12H,4-8,10-11,13-14H2,1-3H3.
What are the key properties of diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane?
diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane has a molecular weight of 239.48 g/mol, XLogP of 4.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-propyl-(3-pyrrolidin-1-ylprop-2-enyl)silane is sourced from PubChem (CID 87398255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).