3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol

C10H21NO3S — CID 114510260

IUPAC3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol
SMILESCCC1CNCCC1(O)CCS(C)(=O)=O
InChIInChI=1S/C10H21NO3S/c1-3-9-8-11-6-4-10(9,12)5-7-15(2,13)14/h9,11-12H,3-8H2,1-2H3
InChIKeySCISXPZKQFFZKU-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.17
Rot. Bonds4

About 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol

3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol (PubChem CID 114510260) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol.

Molecular Properties

Compound Name3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol
PubChem CID114510260
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC Name3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol
SMILESCCC1CNCCC1(O)CCS(C)(=O)=O
InChIInChI=1S/C10H21NO3S/c1-3-9-8-11-6-4-10(9,12)5-7-15(2,13)14/h9,11-12H,3-8H2,1-2H3
InChIKeySCISXPZKQFFZKU-UHFFFAOYSA-N
XLogP0.17
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-4-(2-methylpentyl)piperidin-4-ol
CID 114510431
3-ethyl-4-(thiophen-3-ylmethyl)piperidin-4-ol
CID 114510452
3-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidin-4-ol
CID 114510443
10-ethyl-4-methylsulfonyl-8-azaspiro[4.5]decane
CID 79311040
3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol
CID 114510379
2-(3-ethyl-4-hydroxypiperidin-4-yl)-2-methylpropanenitrile
CID 114510696
3-ethyl-4-methyl-4-propylpiperidine
CID 79321517
3-(2-methylsulfonylethyl)piperidin-3-ol
CID 65145784
4-(3-ethyl-4-hydroxypiperidin-4-yl)oxane-4-carbonitrile
CID 114510704
3-ethyl-4-fluoro-4-methylpiperidine
CID 84716301
3-ethyl-4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-ol
CID 114510495
3-(3-ethyl-4-hydroxypiperidin-4-yl)oxolane-3-carbonitrile
CID 114510705

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol?
The IUPAC name of 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol (CID 114510260) is 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol.
What is the SMILES notation for 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol?
The canonical SMILES for 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol is CCC1CNCCC1(O)CCS(C)(=O)=O.
What is the InChIKey of 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol?
The InChIKey is SCISXPZKQFFZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-3-9-8-11-6-4-10(9,12)5-7-15(2,13)14/h9,11-12H,3-8H2,1-2H3.
What are the key properties of 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol?
3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol has a molecular weight of 235.35 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol is sourced from PubChem (CID 114510260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).