2-hydroxysulfanylpyridine

C5H5NOS — CID 12046445

IUPAC2-hydroxysulfanylpyridine
SMILESOSc1ccccn1
InChIInChI=1S/C5H5NOS/c7-8-5-3-1-2-4-6-5/h1-4,7H
InChIKeyNWTXNJSATUMNHY-UHFFFAOYSA-N
MW127.17 g/mol
LogP1.65
Rot. Bonds1

About 2-hydroxysulfanylpyridine

2-hydroxysulfanylpyridine (PubChem CID 12046445) has the molecular formula C5H5NOS and a molecular weight of 127.17 g/mol. Its IUPAC name is 2-hydroxysulfanylpyridine.

Molecular Properties

Compound Name2-hydroxysulfanylpyridine
PubChem CID12046445
Molecular FormulaC5H5NOS
Molecular Weight127.17 g/mol
Exact Mass127.01
IUPAC Name2-hydroxysulfanylpyridine
SMILESOSc1ccccn1
InChIInChI=1S/C5H5NOS/c7-8-5-3-1-2-4-6-5/h1-4,7H
InChIKeyNWTXNJSATUMNHY-UHFFFAOYSA-N
XLogP1.65
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.17
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(pyridin-2-yldisulfanyl)pyridine;tin(4+);tetrachloride
CID 21452483
ethene;2-(pyridin-2-yldisulfanyl)pyridine
CID 130237828
2-sulfidosulfanylpyridine
CID 102510943
2-(disulfanyl)pyridine;mercury
CID 174835661
2-(pyridin-2-ylhexasulfanyl)pyridine
CID 87930543
pyridin-2-ylsulfanylmethylboronic acid
CID 53216397
[amino(pyridin-2-ylsulfanyl)methylidene]azanium chloride
CID 15311715
(E)-1-pyridin-2-ylsulfanylprop-1-en-1-ol
CID 88974349
S-pyridin-2-yl pyridine-2-carbothioate
CID 121216656
bis(dihydroxy(oxo)phosphanium);2-methylsulfanylpyridine
CID 19865315
pyridin-2-yl methanedithioate
CID 121263494
2-chloro-6-(pyridin-2-yldisulfanyl)pyridine
CID 91874893

Frequently Asked Questions

What is the IUPAC name of 2-hydroxysulfanylpyridine?
The IUPAC name of 2-hydroxysulfanylpyridine (CID 12046445) is 2-hydroxysulfanylpyridine.
What is the SMILES notation for 2-hydroxysulfanylpyridine?
The canonical SMILES for 2-hydroxysulfanylpyridine is OSc1ccccn1.
What is the InChIKey of 2-hydroxysulfanylpyridine?
The InChIKey is NWTXNJSATUMNHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NOS/c7-8-5-3-1-2-4-6-5/h1-4,7H.
What are the key properties of 2-hydroxysulfanylpyridine?
2-hydroxysulfanylpyridine has a molecular weight of 127.17 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxysulfanylpyridine is sourced from PubChem (CID 12046445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).