3-hydroxy-5-methylpiperidine-1-sulfonamide

C6H14N2O3S — CID 130802784

IUPAC3-hydroxy-5-methylpiperidine-1-sulfonamide
SMILESCC1CC(O)CN(S(N)(=O)=O)C1
InChIInChI=1S/C6H14N2O3S/c1-5-2-6(9)4-8(3-5)12(7,10)11/h5-6,9H,2-4H2,1H3,(H2,7,10,11)
InChIKeyCDAJKJXCPBXRML-UHFFFAOYSA-N
MW194.26 g/mol
LogP-1.11
Rot. Bonds1

About 3-hydroxy-5-methylpiperidine-1-sulfonamide

3-hydroxy-5-methylpiperidine-1-sulfonamide (PubChem CID 130802784) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 3-hydroxy-5-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name3-hydroxy-5-methylpiperidine-1-sulfonamide
PubChem CID130802784
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name3-hydroxy-5-methylpiperidine-1-sulfonamide
SMILESCC1CC(O)CN(S(N)(=O)=O)C1
InChIInChI=1S/C6H14N2O3S/c1-5-2-6(9)4-8(3-5)12(7,10)11/h5-6,9H,2-4H2,1H3,(H2,7,10,11)
InChIKeyCDAJKJXCPBXRML-UHFFFAOYSA-N
XLogP-1.11
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-1.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethylpiperidine-1-sulfonamide
CID 43132027
(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride
CID 130610549
1-(bromomethylsulfonyl)-5-methylpiperidin-3-ol
CID 130802766
(3S,5S)-5-methyl-1-(4-methylphenyl)sulfonylpiperidin-3-ol
CID 135044668
(3R,5S)-5-methyl-1-(4-methylphenyl)sulfonylpiperidin-3-ol
CID 135044550
4-hydroxy-2-methylpyrrolidine-1-sulfonamide
CID 131201314
(3S,5S)-1-amino-5-methylpiperidin-3-ol
CID 134534794
(2R,4R)-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-hydroxypyrrolidine-2-carboxylic acid
CID 79000977
(2S,4S)-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-hydroxypyrrolidine-2-carboxylic acid
CID 64713528
(2S,4S)-4-hydroxy-2-methylpiperidine-1-sulfonamide
CID 130692930
1-(3-methylpiperidin-1-yl)sulfonylpiperidin-3-ol
CID 43503036
(3S)-1-(3-methylpiperidin-1-yl)sulfonylpiperidin-3-ol
CID 107225019

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-methylpiperidine-1-sulfonamide?
The IUPAC name of 3-hydroxy-5-methylpiperidine-1-sulfonamide (CID 130802784) is 3-hydroxy-5-methylpiperidine-1-sulfonamide.
What is the SMILES notation for 3-hydroxy-5-methylpiperidine-1-sulfonamide?
The canonical SMILES for 3-hydroxy-5-methylpiperidine-1-sulfonamide is CC1CC(O)CN(S(N)(=O)=O)C1.
What is the InChIKey of 3-hydroxy-5-methylpiperidine-1-sulfonamide?
The InChIKey is CDAJKJXCPBXRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-5-2-6(9)4-8(3-5)12(7,10)11/h5-6,9H,2-4H2,1H3,(H2,7,10,11).
What are the key properties of 3-hydroxy-5-methylpiperidine-1-sulfonamide?
3-hydroxy-5-methylpiperidine-1-sulfonamide has a molecular weight of 194.26 g/mol, XLogP of -1.11, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 130802784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).