[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol

C10H21NO3S — CID 62021560

IUPAC[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol
SMILESCCS(=O)(=O)CCN1CCCCC1CO
InChIInChI=1S/C10H21NO3S/c1-2-15(13,14)8-7-11-6-4-3-5-10(11)9-12/h10,12H,2-9H2,1H3
InChIKeyRWCBIWVDHXMIBY-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.27
Rot. Bonds5

About [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol

[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol (PubChem CID 62021560) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol
PubChem CID62021560
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC Name[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol
SMILESCCS(=O)(=O)CCN1CCCCC1CO
InChIInChI=1S/C10H21NO3S/c1-2-15(13,14)8-7-11-6-4-3-5-10(11)9-12/h10,12H,2-9H2,1H3
InChIKeyRWCBIWVDHXMIBY-UHFFFAOYSA-N
XLogP0.27
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(2-Propan-2-ylsulfonylethyl)piperidin-2-yl]propan-1-ol
CID 71861857
(2R,3S)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-fluorobutan-1-ol
CID 154680480
2-(1,1-Dioxo-1,4-thiazinan-4-yl)-3-fluorobutan-1-ol
CID 155059538
(3S)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-fluorobutan-1-ol
CID 167099795
(1-Ethylsulfonylpiperidin-2-yl)methanol
CID 43574451
3-[2-(2-Methylsulfonylethyl)piperidin-1-yl]propan-1-ol
CID 53810602
2-[2-(2-Methylsulfonylethyl)piperidin-1-yl]ethanol
CID 57251381
Potassium 2-[bis(1-hydroxyhexan-2-yl)amino]ethanesulfonate
CID 58122631
2-[Bis(1-hydroxyhexan-2-yl)amino]ethanesulfonic acid
CID 58122632
Sodium 2-[bis(1-hydroxyhexan-2-yl)amino]ethanesulfonate
CID 58122636
Lithium 2-[bis(1-hydroxyhexan-2-yl)amino]ethanesulfonate
CID 58122641
5-(1,1-Dioxo-1,4-thiazinan-4-yl)pentan-1-ol
CID 58283204

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol (CID 62021560) is [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol is CCS(=O)(=O)CCN1CCCCC1CO.
What is the InChIKey of [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol?
The InChIKey is RWCBIWVDHXMIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-2-15(13,14)8-7-11-6-4-3-5-10(11)9-12/h10,12H,2-9H2,1H3.
What are the key properties of [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol?
[1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol has a molecular weight of 235.35 g/mol, XLogP of 0.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylsulfonylethyl)piperidin-2-yl]methanol is sourced from PubChem (CID 62021560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).