[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane

C42H48N2Si3 — CID 18792371

IUPAC[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane
SMILESCC(C)(C)[Si]1(c2ccccc2)C(c2cccc([Si](C)(C)C)n2)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc([Si](C)(C)C)n1
InChIInChI=1S/C42H48N2Si3/c1-42(2,3)47(33-25-17-12-18-26-33)40(34-27-19-29-36(43-34)45(4,5)6)38(31-21-13-10-14-22-31)39(32-23-15-11-16-24-32)41(47)35-28-20-30-37(44-35)46(7,8)9/h10-30H,1-9H3
InChIKeyGDOHFYGVPWELKZ-UHFFFAOYSA-N
MW665.12 g/mol
LogP9.34
Rot. Bonds7

About [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane

[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane (PubChem CID 18792371) has the molecular formula C42H48N2Si3 and a molecular weight of 665.12 g/mol. Its IUPAC name is [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane.

Molecular Properties

Compound Name[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane
PubChem CID18792371
Molecular FormulaC42H48N2Si3
Molecular Weight665.12 g/mol
Exact Mass664.31
IUPAC Name[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane
SMILESCC(C)(C)[Si]1(c2ccccc2)C(c2cccc([Si](C)(C)C)n2)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc([Si](C)(C)C)n1
InChIInChI=1S/C42H48N2Si3/c1-42(2,3)47(33-25-17-12-18-26-33)40(34-27-19-29-36(43-34)45(4,5)6)38(31-21-13-10-14-22-31)39(32-23-15-11-16-24-32)41(47)35-28-20-30-37(44-35)46(7,8)9/h10-30H,1-9H3
InChIKeyGDOHFYGVPWELKZ-UHFFFAOYSA-N
XLogP9.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500665.12
LogP ≤ 59.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane?
The IUPAC name of [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane (CID 18792371) is [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane.
What is the SMILES notation for [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane?
The canonical SMILES for [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane is CC(C)(C)[Si]1(c2ccccc2)C(c2cccc([Si](C)(C)C)n2)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc([Si](C)(C)C)n1.
What is the InChIKey of [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane?
The InChIKey is GDOHFYGVPWELKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H48N2Si3/c1-42(2,3)47(33-25-17-12-18-26-33)40(34-27-19-29-36(43-34)45(4,5)6)38(31-21-13-10-14-22-31)39(32-23-15-11-16-24-32)41(47)35-28-20-30-37(44-35)46(7,8)9/h10-30H,1-9H3.
What are the key properties of [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane?
[6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane has a molecular weight of 665.12 g/mol, XLogP of 9.34, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[1-tert-butyl-1,3,4-triphenyl-5-(6-trimethylsilyl-2-pyridinyl)silol-2-yl]-2-pyridinyl]-trimethylsilane is sourced from PubChem (CID 18792371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).