4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide

C8H18N2O3S — CID 115969734

IUPAC4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CCC(O)CC1
InChIInChI=1S/C8H18N2O3S/c1-7(2)9-14(12,13)10-5-3-8(11)4-6-10/h7-9,11H,3-6H2,1-2H3
InChIKeyNCEDSNGOGYRHPS-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.31
Rot. Bonds3

About 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide

4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide (PubChem CID 115969734) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide
PubChem CID115969734
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)NS(=O)(=O)N1CCC(O)CC1
InChIInChI=1S/C8H18N2O3S/c1-7(2)9-14(12,13)10-5-3-8(11)4-6-10/h7-9,11H,3-6H2,1-2H3
InChIKeyNCEDSNGOGYRHPS-UHFFFAOYSA-N
XLogP-0.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N,N-dimethylpiperidine-1-sulfonamide
CID 28345236
2-methyl-N-(3,3,3-trifluoro-2-hydroxypropyl)piperidine-1-sulfonamide
CID 103834013
N-(3,3-difluoro-2-hydroxypropyl)-2-methylpiperidine-1-sulfonamide
CID 103836801
N-(2,2-difluoro-3-hydroxypropyl)-2-methylpiperidine-1-sulfonamide
CID 113462919
N-ethyl-4-methoxypiperidine-1-sulfonamide
CID 59254939
4-hydroxy-N-methylpiperidine-1-sulfonamide
CID 59999332
4-hydroxy-N-propylpiperidine-1-sulfonamide
CID 114809333
N-ethyl-N-propan-2-ylpropan-2-amine;piperidin-4-ol
CID 156448794
3-(1-hydroxypropylamino)-N-methylpiperidine-1-sulfonamide
CID 178669978
1-(1-Aminopentan-3-yl)piperidin-4-ol
CID 43367581
N-(3-hydroxypropyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 43501431
[3-Hydroxypropylsulfamoyl(methyl)amino]cyclohexane
CID 43501459

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide?
The IUPAC name of 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide (CID 115969734) is 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide?
The canonical SMILES for 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide is CC(C)NS(=O)(=O)N1CCC(O)CC1.
What is the InChIKey of 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide?
The InChIKey is NCEDSNGOGYRHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-7(2)9-14(12,13)10-5-3-8(11)4-6-10/h7-9,11H,3-6H2,1-2H3.
What are the key properties of 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide?
4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-propan-2-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 115969734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).