(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride

C5H13ClN2O4S — CID 130610549

IUPAC(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride
SMILESCl.NS(=O)(=O)N1C[C@H](O)C[C@H](O)C1
InChIInChI=1S/C5H12N2O4S.ClH/c6-12(10,11)7-2-4(8)1-5(9)3-7;/h4-5,8-9H,1-3H2,(H2,6,10,11);1H/t4-,5+;
InChIKeyCQGBPJZLAOOSAW-JEVYUYNZSA-N
MW232.69 g/mol
LogP-1.96
Rot. Bonds1

About (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride

(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride (PubChem CID 130610549) has the molecular formula C5H13ClN2O4S and a molecular weight of 232.69 g/mol. Its IUPAC name is (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound Name(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride
PubChem CID130610549
Molecular FormulaC5H13ClN2O4S
Molecular Weight232.69 g/mol
Exact Mass232.03
IUPAC Name(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride
SMILESCl.NS(=O)(=O)N1C[C@H](O)C[C@H](O)C1
InChIInChI=1S/C5H12N2O4S.ClH/c6-12(10,11)7-2-4(8)1-5(9)3-7;/h4-5,8-9H,1-3H2,(H2,6,10,11);1H/t4-,5+;
InChIKeyCQGBPJZLAOOSAW-JEVYUYNZSA-N
XLogP-1.96
TPSA103.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.69
LogP ≤ 5-1.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-5-methylpiperidine-1-sulfonamide
CID 130802784
4-hydroxy-2-methylpyrrolidine-1-sulfonamide
CID 131201314
3,5-dimethylpiperidine-1-sulfonamide
CID 43132027
4-hydroxy-1-sulfamoylpyrrolidine-2-carboxamide
CID 112689179
3-fluoroazetidine-1-sulfonamide
CID 70347983
1-(bromomethylsulfonyl)-5-methylpiperidin-3-ol
CID 130802766
(3R)-1-methylsulfonylpyrrolidin-3-ol
CID 78998740
1-methylsulfonylpyrrolidin-3-ol
CID 20745843
1-piperazin-1-ylsulfonylazetidin-3-ol;hydrochloride
CID 138039753
(3R)-1-cyclopropylsulfonylpyrrolidin-3-ol
CID 79030804
(3R,4S)-3,4-dimethylpiperidine-1-sulfonamide
CID 45080623
(2S,4S)-4-hydroxy-2-methylpiperidine-1-sulfonamide
CID 130692930

Frequently Asked Questions

What is the IUPAC name of (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride?
The IUPAC name of (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride (CID 130610549) is (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride is Cl.NS(=O)(=O)N1C[C@H](O)C[C@H](O)C1.
What is the InChIKey of (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride?
The InChIKey is CQGBPJZLAOOSAW-JEVYUYNZSA-N. The full InChI is InChI=1S/C5H12N2O4S.ClH/c6-12(10,11)7-2-4(8)1-5(9)3-7;/h4-5,8-9H,1-3H2,(H2,6,10,11);1H/t4-,5+;.
What are the key properties of (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride?
(3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride has a molecular weight of 232.69 g/mol, XLogP of -1.96, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-3,5-dihydroxypiperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 130610549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).