trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane

C12H21F3N2Si2 — CID 58835983

IUPACtrimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane
SMILESC[Si](C)(C)C(c1ncc(C(F)(F)F)cn1)[Si](C)(C)C
InChIInChI=1S/C12H21F3N2Si2/c1-18(2,3)11(19(4,5)6)10-16-7-9(8-17-10)12(13,14)15/h7-8,11H,1-6H3
InChIKeyXHHZEKKVIFHFDU-UHFFFAOYSA-N
MW306.48 g/mol
LogP4.33
Rot. Bonds3

About trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane

trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane (PubChem CID 58835983) has the molecular formula C12H21F3N2Si2 and a molecular weight of 306.48 g/mol. Its IUPAC name is trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane.

Molecular Properties

Compound Nametrimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane
PubChem CID58835983
Molecular FormulaC12H21F3N2Si2
Molecular Weight306.48 g/mol
Exact Mass306.12
IUPAC Nametrimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane
SMILESC[Si](C)(C)C(c1ncc(C(F)(F)F)cn1)[Si](C)(C)C
InChIInChI=1S/C12H21F3N2Si2/c1-18(2,3)11(19(4,5)6)10-16-7-9(8-17-10)12(13,14)15/h7-8,11H,1-6H3
InChIKeyXHHZEKKVIFHFDU-UHFFFAOYSA-N
XLogP4.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.48
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane?
The IUPAC name of trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane (CID 58835983) is trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane.
What is the SMILES notation for trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane?
The canonical SMILES for trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane is C[Si](C)(C)C(c1ncc(C(F)(F)F)cn1)[Si](C)(C)C.
What is the InChIKey of trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane?
The InChIKey is XHHZEKKVIFHFDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2Si2/c1-18(2,3)11(19(4,5)6)10-16-7-9(8-17-10)12(13,14)15/h7-8,11H,1-6H3.
What are the key properties of trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane?
trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane has a molecular weight of 306.48 g/mol, XLogP of 4.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[5-(trifluoromethyl)pyrimidin-2-yl]-trimethylsilylmethyl]silane is sourced from PubChem (CID 58835983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).