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

C23H27NSi — CID 140738883

IUPACtrimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane
SMILESCCCc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C
InChIInChI=1S/C23H27NSi/c1-5-10-21-16-22(24-17-23(21)25(2,3)4)20-14-9-13-19(15-20)18-11-7-6-8-12-18/h6-9,11-17H,5,10H2,1-4H3
InChIKeyVSWVXOPMRZWUHI-UHFFFAOYSA-N
MW345.56 g/mol
LogP5.91
Rot. Bonds5

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

trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane (PubChem CID 140738883) has the molecular formula C23H27NSi and a molecular weight of 345.56 g/mol. Its IUPAC name is trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane.

Molecular Properties

Compound Nametrimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane
PubChem CID140738883
Molecular FormulaC23H27NSi
Molecular Weight345.56 g/mol
Exact Mass345.19
IUPAC Nametrimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane
SMILESCCCc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C
InChIInChI=1S/C23H27NSi/c1-5-10-21-16-22(24-17-23(21)25(2,3)4)20-14-9-13-19(15-20)18-11-7-6-8-12-18/h6-9,11-17H,5,10H2,1-4H3
InChIKeyVSWVXOPMRZWUHI-UHFFFAOYSA-N
XLogP5.91
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.56
LogP ≤ 55.91
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-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane?
The IUPAC name of trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane (CID 140738883) is trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane is CCCc1cc(-c2cccc(-c3ccccc3)c2)ncc1[Si](C)(C)C.
What is the InChIKey of trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane?
The InChIKey is VSWVXOPMRZWUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NSi/c1-5-10-21-16-22(24-17-23(21)25(2,3)4)20-14-9-13-19(15-20)18-11-7-6-8-12-18/h6-9,11-17H,5,10H2,1-4H3.
What are the key properties of trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane?
trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane has a molecular weight of 345.56 g/mol, XLogP of 5.91, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-(3-phenylphenyl)-4-propyl-3-pyridinyl]silane is sourced from PubChem (CID 140738883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).