trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane

C10H19NO3Si — CID 21106275

IUPACtrimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane
SMILESCCC(c1ccc[nH]1)[Si](OC)(OC)OC
InChIInChI=1S/C10H19NO3Si/c1-5-10(9-7-6-8-11-9)15(12-2,13-3)14-4/h6-8,10-11H,5H2,1-4H3
InChIKeyBSXKJVWCGBCUPR-UHFFFAOYSA-N
MW229.35 g/mol
LogP1.93
Rot. Bonds6

About trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane

trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane (PubChem CID 21106275) has the molecular formula C10H19NO3Si and a molecular weight of 229.35 g/mol. Its IUPAC name is trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane.

Molecular Properties

Compound Nametrimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane
PubChem CID21106275
Molecular FormulaC10H19NO3Si
Molecular Weight229.35 g/mol
Exact Mass229.11
IUPAC Nametrimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane
SMILESCCC(c1ccc[nH]1)[Si](OC)(OC)OC
InChIInChI=1S/C10H19NO3Si/c1-5-10(9-7-6-8-11-9)15(12-2,13-3)14-4/h6-8,10-11H,5H2,1-4H3
InChIKeyBSXKJVWCGBCUPR-UHFFFAOYSA-N
XLogP1.93
TPSA43.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[1-(1H-pyrrol-2-yl)propyl]silane?
The IUPAC name of trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane (CID 21106275) is trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane.
What is the SMILES notation for trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane?
The canonical SMILES for trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane is CCC(c1ccc[nH]1)[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane?
The InChIKey is BSXKJVWCGBCUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3Si/c1-5-10(9-7-6-8-11-9)15(12-2,13-3)14-4/h6-8,10-11H,5H2,1-4H3.
What are the key properties of trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane?
trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane has a molecular weight of 229.35 g/mol, XLogP of 1.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[1-(1H-pyrrol-2-yl)propyl]silane is sourced from PubChem (CID 21106275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).