[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane

C9H14F2N2OSi — CID 70408949

IUPAC[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane
SMILESCc1cc(OC(F)F)nc([Si](C)(C)C)n1
InChIInChI=1S/C9H14F2N2OSi/c1-6-5-7(14-8(10)11)13-9(12-6)15(2,3)4/h5,8H,1-4H3
InChIKeyKYBFAYNOCGFUAJ-UHFFFAOYSA-N
MW232.31 g/mol
LogP1.93
Rot. Bonds3

About [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane

[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane (PubChem CID 70408949) has the molecular formula C9H14F2N2OSi and a molecular weight of 232.31 g/mol. Its IUPAC name is [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane
PubChem CID70408949
Molecular FormulaC9H14F2N2OSi
Molecular Weight232.31 g/mol
Exact Mass232.08
IUPAC Name[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane
SMILESCc1cc(OC(F)F)nc([Si](C)(C)C)n1
InChIInChI=1S/C9H14F2N2OSi/c1-6-5-7(14-8(10)11)13-9(12-6)15(2,3)4/h5,8H,1-4H3
InChIKeyKYBFAYNOCGFUAJ-UHFFFAOYSA-N
XLogP1.93
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 51.93
H-Bond Donors ≤ 50
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 [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane?
The IUPAC name of [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane (CID 70408949) is [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane.
What is the SMILES notation for [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane?
The canonical SMILES for [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane is Cc1cc(OC(F)F)nc([Si](C)(C)C)n1.
What is the InChIKey of [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane?
The InChIKey is KYBFAYNOCGFUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F2N2OSi/c1-6-5-7(14-8(10)11)13-9(12-6)15(2,3)4/h5,8H,1-4H3.
What are the key properties of [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane?
[4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane has a molecular weight of 232.31 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethoxy)-6-methylpyrimidin-2-yl]-trimethylsilane is sourced from PubChem (CID 70408949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).