triethoxy(3-pyrrolidin-1-ylpropyl)silane

C13H29NO3Si — CID 23264964

IUPACtriethoxy(3-pyrrolidin-1-ylpropyl)silane
SMILESCCO[Si](CCCN1CCCC1)(OCC)OCC
InChIInChI=1S/C13H29NO3Si/c1-4-15-18(16-5-2,17-6-3)13-9-12-14-10-7-8-11-14/h4-13H2,1-3H3
InChIKeyLENYMJLFWIMHEP-UHFFFAOYSA-N
MW275.46 g/mol
LogP2.52
Rot. Bonds10

About triethoxy(3-pyrrolidin-1-ylpropyl)silane

triethoxy(3-pyrrolidin-1-ylpropyl)silane (PubChem CID 23264964) has the molecular formula C13H29NO3Si and a molecular weight of 275.46 g/mol. Its IUPAC name is triethoxy(3-pyrrolidin-1-ylpropyl)silane.

Molecular Properties

Compound Nametriethoxy(3-pyrrolidin-1-ylpropyl)silane
PubChem CID23264964
Molecular FormulaC13H29NO3Si
Molecular Weight275.46 g/mol
Exact Mass275.19
IUPAC Nametriethoxy(3-pyrrolidin-1-ylpropyl)silane
SMILESCCO[Si](CCCN1CCCC1)(OCC)OCC
InChIInChI=1S/C13H29NO3Si/c1-4-15-18(16-5-2,17-6-3)13-9-12-14-10-7-8-11-14/h4-13H2,1-3H3
InChIKeyLENYMJLFWIMHEP-UHFFFAOYSA-N
XLogP2.52
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.46
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 triethoxy(3-pyrrolidin-1-ylpropyl)silane?
The IUPAC name of triethoxy(3-pyrrolidin-1-ylpropyl)silane (CID 23264964) is triethoxy(3-pyrrolidin-1-ylpropyl)silane.
What is the SMILES notation for triethoxy(3-pyrrolidin-1-ylpropyl)silane?
The canonical SMILES for triethoxy(3-pyrrolidin-1-ylpropyl)silane is CCO[Si](CCCN1CCCC1)(OCC)OCC.
What is the InChIKey of triethoxy(3-pyrrolidin-1-ylpropyl)silane?
The InChIKey is LENYMJLFWIMHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO3Si/c1-4-15-18(16-5-2,17-6-3)13-9-12-14-10-7-8-11-14/h4-13H2,1-3H3.
What are the key properties of triethoxy(3-pyrrolidin-1-ylpropyl)silane?
triethoxy(3-pyrrolidin-1-ylpropyl)silane has a molecular weight of 275.46 g/mol, XLogP of 2.52, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(3-pyrrolidin-1-ylpropyl)silane is sourced from PubChem (CID 23264964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).