trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane

C9H13F3N2OSi — CID 158424062

IUPACtrimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane
SMILESCc1ncc(C(F)(F)F)c(O[Si](C)(C)C)n1
InChIInChI=1S/C9H13F3N2OSi/c1-6-13-5-7(9(10,11)12)8(14-6)15-16(2,3)4/h5H,1-4H3
InChIKeyZFYBBQHTIYSHBH-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.02
Rot. Bonds2

About trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane

trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane (PubChem CID 158424062) has the molecular formula C9H13F3N2OSi and a molecular weight of 250.30 g/mol. Its IUPAC name is trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane
PubChem CID158424062
Molecular FormulaC9H13F3N2OSi
Molecular Weight250.30 g/mol
Exact Mass250.07
IUPAC Nametrimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane
SMILESCc1ncc(C(F)(F)F)c(O[Si](C)(C)C)n1
InChIInChI=1S/C9H13F3N2OSi/c1-6-13-5-7(9(10,11)12)8(14-6)15-16(2,3)4/h5H,1-4H3
InChIKeyZFYBBQHTIYSHBH-UHFFFAOYSA-N
XLogP3.02
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.02
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 trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane?
The IUPAC name of trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane (CID 158424062) is trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane.
What is the SMILES notation for trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane?
The canonical SMILES for trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane is Cc1ncc(C(F)(F)F)c(O[Si](C)(C)C)n1.
What is the InChIKey of trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane?
The InChIKey is ZFYBBQHTIYSHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F3N2OSi/c1-6-13-5-7(9(10,11)12)8(14-6)15-16(2,3)4/h5H,1-4H3.
What are the key properties of trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane?
trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane has a molecular weight of 250.30 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-methyl-5-(trifluoromethyl)pyrimidin-4-yl]oxysilane is sourced from PubChem (CID 158424062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).