3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide

C9H13FN2O4S — CID 106184850

IUPAC3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide
SMILESCOCC(CO)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O4S/c1-16-6-7(5-13)12-17(14,15)9-8(10)3-2-4-11-9/h2-4,7,12-13H,5-6H2,1H3
InChIKeyHJYAUFHTUHMDEA-UHFFFAOYSA-N
MW264.28 g/mol
LogP-0.49
Rot. Bonds6

About 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide

3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide (PubChem CID 106184850) has the molecular formula C9H13FN2O4S and a molecular weight of 264.28 g/mol. Its IUPAC name is 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide
PubChem CID106184850
Molecular FormulaC9H13FN2O4S
Molecular Weight264.28 g/mol
Exact Mass264.06
IUPAC Name3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide
SMILESCOCC(CO)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O4S/c1-16-6-7(5-13)12-17(14,15)9-8(10)3-2-4-11-9/h2-4,7,12-13H,5-6H2,1H3
InChIKeyHJYAUFHTUHMDEA-UHFFFAOYSA-N
XLogP-0.49
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-fluoro-2-pyridinyl)sulfonylamino]-5-methoxypentanoic acid
CID 103298878
3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide
CID 103300372
3-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-2-sulfonamide
CID 103300164
3-hydrazinyl-N-(1-methoxybutan-2-yl)pyridine-2-sulfonamide
CID 103301625
N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306201
N-(4-bromopentan-2-yl)-3-fluoropyridine-2-sulfonamide
CID 103308397
N-but-3-en-2-yl-3-fluoropyridine-2-sulfonamide
CID 103300448
5-amino-2,4-difluoro-N-(1-hydroxy-3-methoxypropan-2-yl)benzenesulfonamide
CID 106181976
3-[(3-fluoro-2-pyridinyl)sulfonylamino]-4,4-dimethylpentanoic acid
CID 103298907
N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide
CID 103299268
N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
CID 103300114
N-[4-(dimethylamino)butan-2-yl]-3-fluoropyridine-2-sulfonamide
CID 103299907

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide (CID 106184850) is 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide is COCC(CO)NS(=O)(=O)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide?
The InChIKey is HJYAUFHTUHMDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2O4S/c1-16-6-7(5-13)12-17(14,15)9-8(10)3-2-4-11-9/h2-4,7,12-13H,5-6H2,1H3.
What are the key properties of 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide?
3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide has a molecular weight of 264.28 g/mol, XLogP of -0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 106184850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).