N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide

C9H14N2O5S — CID 106197387

IUPACN-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOCC(CO)NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C9H14N2O5S/c1-16-6-7(5-12)11-17(14,15)8-2-3-9(13)10-4-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13)
InChIKeyFDOHDLKZNDODDS-UHFFFAOYSA-N
MW262.29 g/mol
LogP-1.34
Rot. Bonds6

About N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide

N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 106197387) has the molecular formula C9H14N2O5S and a molecular weight of 262.29 g/mol. Its IUPAC name is N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID106197387
Molecular FormulaC9H14N2O5S
Molecular Weight262.29 g/mol
Exact Mass262.06
IUPAC NameN-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOCC(CO)NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C9H14N2O5S/c1-16-6-7(5-12)11-17(14,15)8-2-3-9(13)10-4-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13)
InChIKeyFDOHDLKZNDODDS-UHFFFAOYSA-N
XLogP-1.34
TPSA108.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629090
4-amino-N-(1-hydroxy-3-methoxypropan-2-yl)benzenesulfonamide
CID 114094501
N-(4-methoxybutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64605936
N-(3-methylpentan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 54955517
N-(3-methylbutan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629183
2-chloro-5-[(1-hydroxy-3-methoxypropan-2-yl)sulfamoyl]benzoic acid
CID 106185797
N-methoxy-6-oxo-1H-pyridine-3-sulfonamide
CID 107858243
N-(2-methylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629041
4-amino-N-(1-hydroxy-3-methoxypropan-2-yl)-2-methoxybenzenesulfonamide
CID 106181722
4-[(1-hydroxy-3-methoxypropan-2-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 106185920
2-amino-4-bromo-N-(1-hydroxy-3-methoxypropan-2-yl)benzenesulfonamide
CID 106181731
N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61479202

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide (CID 106197387) is N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide is COCC(CO)NS(=O)(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is FDOHDLKZNDODDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O5S/c1-16-6-7(5-12)11-17(14,15)8-2-3-9(13)10-4-8/h2-4,7,11-12H,5-6H2,1H3,(H,10,13).
What are the key properties of N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 262.29 g/mol, XLogP of -1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methoxypropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 106197387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).