(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane

C8H12BrNSSi — CID 101466629

IUPAC(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane
SMILESC[Si](C)(C)Sc1ccc(Br)cn1
InChIInChI=1S/C8H12BrNSSi/c1-12(2,3)11-8-5-4-7(9)6-10-8/h4-6H,1-3H3
InChIKeyDGWNUVHILDDRDU-UHFFFAOYSA-N
MW262.25 g/mol
LogP3.77
Rot. Bonds2

About (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane

(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane (PubChem CID 101466629) has the molecular formula C8H12BrNSSi and a molecular weight of 262.25 g/mol. Its IUPAC name is (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane.

Molecular Properties

Compound Name(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane
PubChem CID101466629
Molecular FormulaC8H12BrNSSi
Molecular Weight262.25 g/mol
Exact Mass260.96
IUPAC Name(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane
SMILESC[Si](C)(C)Sc1ccc(Br)cn1
InChIInChI=1S/C8H12BrNSSi/c1-12(2,3)11-8-5-4-7(9)6-10-8/h4-6H,1-3H3
InChIKeyDGWNUVHILDDRDU-UHFFFAOYSA-N
XLogP3.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.25
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

S-(5-bromo-2-pyridinyl)thiohydroxylamine
CID 177140372
5-bromo-2-butan-2-ylsulfanylpyridine
CID 61373794
trimethyl-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]silane
CID 640487
5-bromo-2-(4-methylphenyl)sulfanylpyridine
CID 55219804
2-[(5-bromo-2-pyridinyl)sulfanyl]ethanol
CID 43446269
2,5-dibromopyridine;ethane
CID 90871570
4-[(5-bromo-2-pyridinyl)sulfanyl]butan-2-one
CID 61339572
2-[(5-bromo-2-pyridinyl)sulfanyl]-5-methylpyridin-4-amine
CID 83270139
4-[(5-bromo-2-pyridinyl)sulfanyl]pyridin-3-amine
CID 62112804
6-[(5-bromo-2-pyridinyl)sulfanyl]pyridine-3-carbaldehyde
CID 80639451
(1R)-1-[2-[(5-bromo-2-pyridinyl)sulfanyl]phenyl]ethanamine
CID 78992842
5-bromo-2-(4-methylsulfonylphenyl)sulfanylpyridine
CID 63237967

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane?
The IUPAC name of (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane (CID 101466629) is (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane.
What is the SMILES notation for (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane?
The canonical SMILES for (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane is C[Si](C)(C)Sc1ccc(Br)cn1.
What is the InChIKey of (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane?
The InChIKey is DGWNUVHILDDRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12BrNSSi/c1-12(2,3)11-8-5-4-7(9)6-10-8/h4-6H,1-3H3.
What are the key properties of (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane?
(5-bromo-2-pyridinyl)sulfanyl-trimethylsilane has a molecular weight of 262.25 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-pyridinyl)sulfanyl-trimethylsilane is sourced from PubChem (CID 101466629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).