trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane

C21H23NSi — CID 140710280

IUPACtrimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane
SMILESCc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C
InChIInChI=1S/C21H23NSi/c1-16-13-20(22-15-21(16)23(2,3)4)19-12-8-11-18(14-19)17-9-6-5-7-10-17/h5-15H,1-4H3
InChIKeyAUJMALBHKNUPFR-UHFFFAOYSA-N
MW317.51 g/mol
LogP5.27
Rot. Bonds3

About trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane

trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane (PubChem CID 140710280) has the molecular formula C21H23NSi and a molecular weight of 317.51 g/mol. Its IUPAC name is trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane
PubChem CID140710280
Molecular FormulaC21H23NSi
Molecular Weight317.51 g/mol
Exact Mass317.16
IUPAC Nametrimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane
SMILESCc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C
InChIInChI=1S/C21H23NSi/c1-16-13-20(22-15-21(16)23(2,3)4)19-12-8-11-18(14-19)17-9-6-5-7-10-17/h5-15H,1-4H3
InChIKeyAUJMALBHKNUPFR-UHFFFAOYSA-N
XLogP5.27
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.51
LogP ≤ 55.27
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-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane?
The IUPAC name of trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane (CID 140710280) is trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane is Cc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.
What is the InChIKey of trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane?
The InChIKey is AUJMALBHKNUPFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NSi/c1-16-13-20(22-15-21(16)23(2,3)4)19-12-8-11-18(14-19)17-9-6-5-7-10-17/h5-15H,1-4H3.
What are the key properties of trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane?
trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane has a molecular weight of 317.51 g/mol, XLogP of 5.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-methyl-6-(3-phenylphenyl)-3-pyridinyl]silane is sourced from PubChem (CID 140710280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).