trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane

C25H24N2Si — CID 174068542

IUPACtrimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane
SMILESC[Si](C)(C)c1nc(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C25H24N2Si/c1-28(2,3)25-26-23(20-15-9-5-10-16-20)22(19-13-7-4-8-14-19)24(27-25)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKeyJQLOUDVYRYUTFS-UHFFFAOYSA-N
MW380.57 g/mol
LogP6.02
Rot. Bonds4

About trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane

trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane (PubChem CID 174068542) has the molecular formula C25H24N2Si and a molecular weight of 380.57 g/mol. Its IUPAC name is trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane.

Molecular Properties

Compound Nametrimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane
PubChem CID174068542
Molecular FormulaC25H24N2Si
Molecular Weight380.57 g/mol
Exact Mass380.17
IUPAC Nametrimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane
SMILESC[Si](C)(C)c1nc(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C25H24N2Si/c1-28(2,3)25-26-23(20-15-9-5-10-16-20)22(19-13-7-4-8-14-19)24(27-25)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKeyJQLOUDVYRYUTFS-UHFFFAOYSA-N
XLogP6.02
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.57
LogP ≤ 56.02
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-(4,5,6-triphenylpyrimidin-2-yl)silane?
The IUPAC name of trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane (CID 174068542) is trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane.
What is the SMILES notation for trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane?
The canonical SMILES for trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane is C[Si](C)(C)c1nc(-c2ccccc2)c(-c2ccccc2)c(-c2ccccc2)n1.
What is the InChIKey of trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane?
The InChIKey is JQLOUDVYRYUTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2Si/c1-28(2,3)25-26-23(20-15-9-5-10-16-20)22(19-13-7-4-8-14-19)24(27-25)21-17-11-6-12-18-21/h4-18H,1-3H3.
What are the key properties of trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane?
trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane has a molecular weight of 380.57 g/mol, XLogP of 6.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(4,5,6-triphenylpyrimidin-2-yl)silane is sourced from PubChem (CID 174068542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).