dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane

C19H19NSi — CID 140737904

IUPACdimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane
SMILES[2H]c1cc(-c2ccc([Si](C)(C)c3ccccc3)cn2)c([2H])c([2H])c1[2H]
InChIInChI=1S/C19H19NSi/c1-21(2,17-11-7-4-8-12-17)18-13-14-19(20-15-18)16-9-5-3-6-10-16/h3-15H,1-2H3/i3D,5D,6D,9D
InChIKeyYOHBHNCNJXCTJG-FZWVDBJPSA-N
MW293.48 g/mol
LogP3.57
Rot. Bonds3

About dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane

dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane (PubChem CID 140737904) has the molecular formula C19H19NSi and a molecular weight of 293.48 g/mol. Its IUPAC name is dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane.

Molecular Properties

Compound Namedimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane
PubChem CID140737904
Molecular FormulaC19H19NSi
Molecular Weight293.48 g/mol
Exact Mass293.15
IUPAC Namedimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane
SMILES[2H]c1cc(-c2ccc([Si](C)(C)c3ccccc3)cn2)c([2H])c([2H])c1[2H]
InChIInChI=1S/C19H19NSi/c1-21(2,17-11-7-4-8-12-17)18-13-14-19(20-15-18)16-9-5-3-6-10-16/h3-15H,1-2H3/i3D,5D,6D,9D
InChIKeyYOHBHNCNJXCTJG-FZWVDBJPSA-N
XLogP3.57
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.48
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane?
The IUPAC name of dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane (CID 140737904) is dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane.
What is the SMILES notation for dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane?
The canonical SMILES for dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane is [2H]c1cc(-c2ccc([Si](C)(C)c3ccccc3)cn2)c([2H])c([2H])c1[2H].
What is the InChIKey of dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane?
The InChIKey is YOHBHNCNJXCTJG-FZWVDBJPSA-N. The full InChI is InChI=1S/C19H19NSi/c1-21(2,17-11-7-4-8-12-17)18-13-14-19(20-15-18)16-9-5-3-6-10-16/h3-15H,1-2H3/i3D,5D,6D,9D.
What are the key properties of dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane?
dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane has a molecular weight of 293.48 g/mol, XLogP of 3.57, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-phenyl-[6-(2,3,4,5-tetradeuteriophenyl)-3-pyridinyl]silane is sourced from PubChem (CID 140737904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).