2-pyridin-2-ylsulfanylcyclohexan-1-ol

C11H15NOS — CID 13434052

IUPAC2-pyridin-2-ylsulfanylcyclohexan-1-ol
SMILESOC1CCCCC1Sc1ccccn1
InChIInChI=1S/C11H15NOS/c13-9-5-1-2-6-10(9)14-11-7-3-4-8-12-11/h3-4,7-10,13H,1-2,5-6H2
InChIKeyDRFVRSLJSUBFJC-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.48
Rot. Bonds2

About 2-pyridin-2-ylsulfanylcyclohexan-1-ol

2-pyridin-2-ylsulfanylcyclohexan-1-ol (PubChem CID 13434052) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is 2-pyridin-2-ylsulfanylcyclohexan-1-ol.

Molecular Properties

Compound Name2-pyridin-2-ylsulfanylcyclohexan-1-ol
PubChem CID13434052
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name2-pyridin-2-ylsulfanylcyclohexan-1-ol
SMILESOC1CCCCC1Sc1ccccn1
InChIInChI=1S/C11H15NOS/c13-9-5-1-2-6-10(9)14-11-7-3-4-8-12-11/h3-4,7-10,13H,1-2,5-6H2
InChIKeyDRFVRSLJSUBFJC-UHFFFAOYSA-N
XLogP2.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-pyridin-2-ylsulfanylcyclohexan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

(1R)-2-(pyridin-2-yldisulfanyl)cyclopentan-1-ol
CID 168894711
4-pyridin-2-ylsulfanylpyrrolidin-3-ol
CID 63703170
N-ethyl-2-pyridin-2-ylsulfanylcyclohexan-1-amine
CID 64649496
2-[(3-amino-2-pyridinyl)sulfanyl]cyclohexan-1-ol
CID 60883980
trans-(1R,2R)-2-[(3-bromo-2-pyridinyl)sulfanyl]cyclohexan-1-ol
CID 102732838
2-[[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]sulfanyl]pyridine
CID 10998160
2-[(2-methylcyclohexyl)disulfanyl]pyridine
CID 155476291
2-[(4Z)-8-chlorocyclooct-4-en-1-yl]sulfanylpyridine
CID 155292873
4-chloro-N-[(1S,2R)-2-pyridin-2-ylsulfanylcyclohexyl]benzenesulfonamide
CID 1167631
4-methyl-3-pyridin-2-ylsulfanylcyclohexan-1-one
CID 165497200
S-pyridin-2-yl cyclohexanecarbothioate
CID 12531414
2-[[(3aR,4R,7aS)-3,3-dichloro-2,2-difluoro-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]sulfanyl]pyridine
CID 10568991

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-ylsulfanylcyclohexan-1-ol?
The IUPAC name of 2-pyridin-2-ylsulfanylcyclohexan-1-ol (CID 13434052) is 2-pyridin-2-ylsulfanylcyclohexan-1-ol.
What is the SMILES notation for 2-pyridin-2-ylsulfanylcyclohexan-1-ol?
The canonical SMILES for 2-pyridin-2-ylsulfanylcyclohexan-1-ol is OC1CCCCC1Sc1ccccn1.
What is the InChIKey of 2-pyridin-2-ylsulfanylcyclohexan-1-ol?
The InChIKey is DRFVRSLJSUBFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c13-9-5-1-2-6-10(9)14-11-7-3-4-8-12-11/h3-4,7-10,13H,1-2,5-6H2.
What are the key properties of 2-pyridin-2-ylsulfanylcyclohexan-1-ol?
2-pyridin-2-ylsulfanylcyclohexan-1-ol has a molecular weight of 209.31 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-ylsulfanylcyclohexan-1-ol is sourced from PubChem (CID 13434052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).