2-(1-methylsulfonylpiperidin-2-yl)ethanol

C8H17NO3S — CID 60956631

IUPAC2-(1-methylsulfonylpiperidin-2-yl)ethanol
SMILESCS(=O)(=O)N1CCCCC1CCO
InChIInChI=1S/C8H17NO3S/c1-13(11,12)9-6-3-2-4-8(9)5-7-10/h8,10H,2-7H2,1H3
InChIKeyJHAXMXZYBWMHEC-UHFFFAOYSA-N
MW207.29 g/mol
LogP0.18
Rot. Bonds3

About 2-(1-methylsulfonylpiperidin-2-yl)ethanol

2-(1-methylsulfonylpiperidin-2-yl)ethanol (PubChem CID 60956631) has the molecular formula C8H17NO3S and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(1-methylsulfonylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-methylsulfonylpiperidin-2-yl)ethanol
PubChem CID60956631
Molecular FormulaC8H17NO3S
Molecular Weight207.29 g/mol
Exact Mass207.09
IUPAC Name2-(1-methylsulfonylpiperidin-2-yl)ethanol
SMILESCS(=O)(=O)N1CCCCC1CCO
InChIInChI=1S/C8H17NO3S/c1-13(11,12)9-6-3-2-4-8(9)5-7-10/h8,10H,2-7H2,1H3
InChIKeyJHAXMXZYBWMHEC-UHFFFAOYSA-N
XLogP0.18
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxyethyl)piperidine-1-sulfonamide
CID 112689810
2-[1-(cyclopropylmethylsulfonyl)piperidin-2-yl]ethanol
CID 64988050
1-methylsulfonyl-2-propylpyrrolidine
CID 59852648
1-(1-methylsulfonylazepan-2-yl)propan-2-ol
CID 79559855
2-[1-(3-chloropropylsulfonyl)piperidin-2-yl]ethanol
CID 43654461
(2S)-1-methylsulfonyl-2-(2-propan-2-yloxyethyl)piperidine
CID 96516255
[2-(2-hydroxyethyl)piperidin-1-yl]-(1-methylsulfonylpiperidin-4-yl)methanone
CID 60741388
2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]ethanol
CID 54878321
2-(3-bromopropyl)-1-methylsulfonylpyrrolidine
CID 80675195
7-[2-(1-methylsulfonylpiperidin-2-yl)ethyl]azepan-2-amine
CID 173232761
2-[1-[2-(hydroxymethyl)piperidin-1-yl]piperidin-2-yl]ethanol
CID 57022132
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylsulfonylpiperidin-2-yl)ethanol?
The IUPAC name of 2-(1-methylsulfonylpiperidin-2-yl)ethanol (CID 60956631) is 2-(1-methylsulfonylpiperidin-2-yl)ethanol.
What is the SMILES notation for 2-(1-methylsulfonylpiperidin-2-yl)ethanol?
The canonical SMILES for 2-(1-methylsulfonylpiperidin-2-yl)ethanol is CS(=O)(=O)N1CCCCC1CCO.
What is the InChIKey of 2-(1-methylsulfonylpiperidin-2-yl)ethanol?
The InChIKey is JHAXMXZYBWMHEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3S/c1-13(11,12)9-6-3-2-4-8(9)5-7-10/h8,10H,2-7H2,1H3.
What are the key properties of 2-(1-methylsulfonylpiperidin-2-yl)ethanol?
2-(1-methylsulfonylpiperidin-2-yl)ethanol has a molecular weight of 207.29 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylsulfonylpiperidin-2-yl)ethanol is sourced from PubChem (CID 60956631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).