trimethoxy(2-pyridin-2-ylethyl)silane

C20H34N2O6Si2 — CID 158126739

IUPACtrimethoxy(2-pyridin-2-ylethyl)silane
SMILESCO[Si](CCc1ccccn1)(OC)OC.CO[Si](CCc1ccccn1)(OC)OC
InChIInChI=1S/2C10H17NO3Si/c2*1-12-15(13-2,14-3)9-7-10-6-4-5-8-11-10/h2*4-6,8H,7,9H2,1-3H3
InChIKeyFSGPXUQBELMJBC-UHFFFAOYSA-N
MW454.67 g/mol
LogP3.00
Rot. Bonds12

About trimethoxy(2-pyridin-2-ylethyl)silane

trimethoxy(2-pyridin-2-ylethyl)silane (PubChem CID 158126739) has the molecular formula C20H34N2O6Si2 and a molecular weight of 454.67 g/mol. Its IUPAC name is trimethoxy(2-pyridin-2-ylethyl)silane.

Molecular Properties

Compound Nametrimethoxy(2-pyridin-2-ylethyl)silane
PubChem CID158126739
Molecular FormulaC20H34N2O6Si2
Molecular Weight454.67 g/mol
Exact Mass454.20
IUPAC Nametrimethoxy(2-pyridin-2-ylethyl)silane
SMILESCO[Si](CCc1ccccn1)(OC)OC.CO[Si](CCc1ccccn1)(OC)OC
InChIInChI=1S/2C10H17NO3Si/c2*1-12-15(13-2,14-3)9-7-10-6-4-5-8-11-10/h2*4-6,8H,7,9H2,1-3H3
InChIKeyFSGPXUQBELMJBC-UHFFFAOYSA-N
XLogP3.00
TPSA81.16 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.67
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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 trimethoxy(2-pyridin-2-ylethyl)silane?
The IUPAC name of trimethoxy(2-pyridin-2-ylethyl)silane (CID 158126739) is trimethoxy(2-pyridin-2-ylethyl)silane.
What is the SMILES notation for trimethoxy(2-pyridin-2-ylethyl)silane?
The canonical SMILES for trimethoxy(2-pyridin-2-ylethyl)silane is CO[Si](CCc1ccccn1)(OC)OC.CO[Si](CCc1ccccn1)(OC)OC.
What is the InChIKey of trimethoxy(2-pyridin-2-ylethyl)silane?
The InChIKey is FSGPXUQBELMJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H17NO3Si/c2*1-12-15(13-2,14-3)9-7-10-6-4-5-8-11-10/h2*4-6,8H,7,9H2,1-3H3.
What are the key properties of trimethoxy(2-pyridin-2-ylethyl)silane?
trimethoxy(2-pyridin-2-ylethyl)silane has a molecular weight of 454.67 g/mol, XLogP of 3.00, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(2-pyridin-2-ylethyl)silane is sourced from PubChem (CID 158126739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).