(1-methylsulfonylpiperidin-2-yl)methanol

C7H15NO3S — CID 3330234

IUPAC(1-methylsulfonylpiperidin-2-yl)methanol
SMILESCS(=O)(=O)N1CCCCC1CO
InChIInChI=1S/C7H15NO3S/c1-12(10,11)8-5-3-2-4-7(8)6-9/h7,9H,2-6H2,1H3
InChIKeyFLCRKCCKSJQLQA-UHFFFAOYSA-N
MW193.27 g/mol
LogP-0.21
Rot. Bonds2

About (1-methylsulfonylpiperidin-2-yl)methanol

(1-methylsulfonylpiperidin-2-yl)methanol (PubChem CID 3330234) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is (1-methylsulfonylpiperidin-2-yl)methanol.

Molecular Properties

Compound Name(1-methylsulfonylpiperidin-2-yl)methanol
PubChem CID3330234
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name(1-methylsulfonylpiperidin-2-yl)methanol
SMILESCS(=O)(=O)N1CCCCC1CO
InChIInChI=1S/C7H15NO3S/c1-12(10,11)8-5-3-2-4-7(8)6-9/h7,9H,2-6H2,1H3
InChIKeyFLCRKCCKSJQLQA-UHFFFAOYSA-N
XLogP-0.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methylsulfonylpiperidin-2-yl)methanol?
The IUPAC name of (1-methylsulfonylpiperidin-2-yl)methanol (CID 3330234) is (1-methylsulfonylpiperidin-2-yl)methanol.
What is the SMILES notation for (1-methylsulfonylpiperidin-2-yl)methanol?
The canonical SMILES for (1-methylsulfonylpiperidin-2-yl)methanol is CS(=O)(=O)N1CCCCC1CO.
What is the InChIKey of (1-methylsulfonylpiperidin-2-yl)methanol?
The InChIKey is FLCRKCCKSJQLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-12(10,11)8-5-3-2-4-7(8)6-9/h7,9H,2-6H2,1H3.
What are the key properties of (1-methylsulfonylpiperidin-2-yl)methanol?
(1-methylsulfonylpiperidin-2-yl)methanol has a molecular weight of 193.27 g/mol, XLogP of -0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylsulfonylpiperidin-2-yl)methanol is sourced from PubChem (CID 3330234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).