2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol

C10H8N2O2S2 — CID 581654

IUPAC2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol
SMILESOc1cccnc1SSc1ncccc1O
InChIInChI=1S/C10H8N2O2S2/c13-7-3-1-5-11-9(7)15-16-10-8(14)4-2-6-12-10/h1-6,13-14H
InChIKeyOMVDCMUSGMBLMK-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.69
Rot. Bonds3

About 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol

2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol (PubChem CID 581654) has the molecular formula C10H8N2O2S2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol.

Molecular Properties

Compound Name2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol
PubChem CID581654
Molecular FormulaC10H8N2O2S2
Molecular Weight252.32 g/mol
Exact Mass252.00
IUPAC Name2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol
SMILESOc1cccnc1SSc1ncccc1O
InChIInChI=1S/C10H8N2O2S2/c13-7-3-1-5-11-9(7)15-16-10-8(14)4-2-6-12-10/h1-6,13-14H
InChIKeyOMVDCMUSGMBLMK-UHFFFAOYSA-N
XLogP2.69
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-ethenylsulfanylpyridin-3-ol
CID 12559065
CID 87574470
CID 87574470
3-pyridin-2-yl-2-[(3-pyridin-2-yl-2-pyridinyl)disulfanyl]pyridine
CID 141048540
2-[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]sulfanylpyridin-3-ol
CID 67277031
2-[(E)-(3-hydroxy-2-pyridinyl)diazenyl]pyridin-3-ol
CID 137201296
2-aminopyridin-3-ol;methane
CID 175038477
2-iodopyridin-3-ol;hydrochloride
CID 141441787
CID 70016201
CID 70016201
[2-[(3-benzoyloxy-2-pyridinyl)disulfanyl]-3-pyridinyl] benzoate
CID 570399
quinolin-8-ol;yttrium
CID 174635627
CID 54604144
CID 54604144
2-chloropyridin-3-ol;ethane
CID 144796414

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol?
The IUPAC name of 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol (CID 581654) is 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol.
What is the SMILES notation for 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol?
The canonical SMILES for 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol is Oc1cccnc1SSc1ncccc1O.
What is the InChIKey of 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol?
The InChIKey is OMVDCMUSGMBLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2S2/c13-7-3-1-5-11-9(7)15-16-10-8(14)4-2-6-12-10/h1-6,13-14H.
What are the key properties of 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol?
2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol has a molecular weight of 252.32 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxy-2-pyridinyl)disulfanyl]pyridin-3-ol is sourced from PubChem (CID 581654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).