3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide

C9H13FN2O3S — CID 103300372

IUPAC3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide
SMILESCC(CCO)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O3S/c1-7(4-6-13)12-16(14,15)9-8(10)3-2-5-11-9/h2-3,5,7,12-13H,4,6H2,1H3
InChIKeyFKIKERNVDBTPOC-UHFFFAOYSA-N
MW248.28 g/mol
LogP0.27
Rot. Bonds5

About 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide

3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide (PubChem CID 103300372) has the molecular formula C9H13FN2O3S and a molecular weight of 248.28 g/mol. Its IUPAC name is 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide
PubChem CID103300372
Molecular FormulaC9H13FN2O3S
Molecular Weight248.28 g/mol
Exact Mass248.06
IUPAC Name3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide
SMILESCC(CCO)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O3S/c1-7(4-6-13)12-16(14,15)9-8(10)3-2-5-11-9/h2-3,5,7,12-13H,4,6H2,1H3
InChIKeyFKIKERNVDBTPOC-UHFFFAOYSA-N
XLogP0.27
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(dimethylamino)butan-2-yl]-3-fluoropyridine-2-sulfonamide
CID 103299907
5-[(3-fluoro-2-pyridinyl)sulfonylamino]hexanoic acid
CID 103298911
3-fluoro-N-octan-2-ylpyridine-2-sulfonamide
CID 103299597
N-(4-bromopentan-2-yl)-3-fluoropyridine-2-sulfonamide
CID 103308397
N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
CID 103300114
3-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-2-sulfonamide
CID 103300164
3-fluoro-N-(1-hydroxy-3-methoxypropan-2-yl)pyridine-2-sulfonamide
CID 106184850
N-but-3-en-2-yl-3-fluoropyridine-2-sulfonamide
CID 103300448
N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
CID 103308189
N-(4-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 115477930
3-[(3-fluoro-2-pyridinyl)sulfonylamino]-4,4-dimethylpentanoic acid
CID 103298907
2-[(3-fluoro-2-pyridinyl)sulfonylamino]-5-methoxypentanoic acid
CID 103298878

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide (CID 103300372) is 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide is CC(CCO)NS(=O)(=O)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide?
The InChIKey is FKIKERNVDBTPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2O3S/c1-7(4-6-13)12-16(14,15)9-8(10)3-2-5-11-9/h2-3,5,7,12-13H,4,6H2,1H3.
What are the key properties of 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide?
3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide has a molecular weight of 248.28 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(4-hydroxybutan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103300372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).