trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane

C20H21NSi — CID 157387060

IUPACtrimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc(-c3ccccn3)cc2)cc1
InChIInChI=1S/C20H21NSi/c1-22(2,3)19-13-11-17(12-14-19)16-7-9-18(10-8-16)20-6-4-5-15-21-20/h4-15H,1-3H3
InChIKeyGNMFZVCUZWBHMU-UHFFFAOYSA-N
MW303.48 g/mol
LogP4.96
Rot. Bonds3

About trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane

trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane (PubChem CID 157387060) has the molecular formula C20H21NSi and a molecular weight of 303.48 g/mol. Its IUPAC name is trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane
PubChem CID157387060
Molecular FormulaC20H21NSi
Molecular Weight303.48 g/mol
Exact Mass303.14
IUPAC Nametrimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc(-c3ccccn3)cc2)cc1
InChIInChI=1S/C20H21NSi/c1-22(2,3)19-13-11-17(12-14-19)16-7-9-18(10-8-16)20-6-4-5-15-21-20/h4-15H,1-3H3
InChIKeyGNMFZVCUZWBHMU-UHFFFAOYSA-N
XLogP4.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 54.96
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 trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane?
The IUPAC name of trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane (CID 157387060) is trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane.
What is the SMILES notation for trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane?
The canonical SMILES for trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane is C[Si](C)(C)c1ccc(-c2ccc(-c3ccccn3)cc2)cc1.
What is the InChIKey of trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane?
The InChIKey is GNMFZVCUZWBHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NSi/c1-22(2,3)19-13-11-17(12-14-19)16-7-9-18(10-8-16)20-6-4-5-15-21-20/h4-15H,1-3H3.
What are the key properties of trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane?
trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane has a molecular weight of 303.48 g/mol, XLogP of 4.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-(4-pyridin-2-ylphenyl)phenyl]silane is sourced from PubChem (CID 157387060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).