2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane

C10H18N2O2Si — CID 139782052

IUPAC2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane
SMILESCOc1cc(OCC[Si](C)(C)C)ncn1
InChIInChI=1S/C10H18N2O2Si/c1-13-9-7-10(12-8-11-9)14-5-6-15(2,3)4/h7-8H,5-6H2,1-4H3
InChIKeyJTCIFKKDRPJSTL-UHFFFAOYSA-N
MW226.35 g/mol
LogP2.20
Rot. Bonds5

About 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane

2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane (PubChem CID 139782052) has the molecular formula C10H18N2O2Si and a molecular weight of 226.35 g/mol. Its IUPAC name is 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane.

Molecular Properties

Compound Name2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane
PubChem CID139782052
Molecular FormulaC10H18N2O2Si
Molecular Weight226.35 g/mol
Exact Mass226.11
IUPAC Name2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane
SMILESCOc1cc(OCC[Si](C)(C)C)ncn1
InChIInChI=1S/C10H18N2O2Si/c1-13-9-7-10(12-8-11-9)14-5-6-15(2,3)4/h7-8H,5-6H2,1-4H3
InChIKeyJTCIFKKDRPJSTL-UHFFFAOYSA-N
XLogP2.20
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 52.20
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 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane?
The IUPAC name of 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane (CID 139782052) is 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane.
What is the SMILES notation for 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane?
The canonical SMILES for 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane is COc1cc(OCC[Si](C)(C)C)ncn1.
What is the InChIKey of 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane?
The InChIKey is JTCIFKKDRPJSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2Si/c1-13-9-7-10(12-8-11-9)14-5-6-15(2,3)4/h7-8H,5-6H2,1-4H3.
What are the key properties of 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane?
2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane has a molecular weight of 226.35 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxypyrimidin-4-yl)oxyethyl-trimethylsilane is sourced from PubChem (CID 139782052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).