N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide

C7H9FN2O3S — CID 54276557

IUPACN-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC(O)CF)c1cccnc1
InChIInChI=1S/C7H9FN2O3S/c8-4-7(11)10-14(12,13)6-2-1-3-9-5-6/h1-3,5,7,10-11H,4H2
InChIKeyRNUUQFISCVQQSL-UHFFFAOYSA-N
MW220.22 g/mol
LogP-0.35
Rot. Bonds4

About N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide

N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide (PubChem CID 54276557) has the molecular formula C7H9FN2O3S and a molecular weight of 220.22 g/mol. Its IUPAC name is N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide
PubChem CID54276557
Molecular FormulaC7H9FN2O3S
Molecular Weight220.22 g/mol
Exact Mass220.03
IUPAC NameN-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC(O)CF)c1cccnc1
InChIInChI=1S/C7H9FN2O3S/c8-4-7(11)10-14(12,13)6-2-1-3-9-5-6/h1-3,5,7,10-11H,4H2
InChIKeyRNUUQFISCVQQSL-UHFFFAOYSA-N
XLogP-0.35
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-Pyridinesulfonic acid
CID 69468
Pyridine sulfonamide
CID 12000791
Pyridine-3-sulfonamide
CID 232710
3-(Piperidin-1-ylsulphonyl)pyridine
CID 3623948
4-(Allylamino)-3-pyridinesulfonamide
CID 25044690
Pyridine-3-sulfonyl chloride
CID 3164136
Pyridine-4-sulfonamide
CID 12383449
3-[(Pyrrolidin-1-yl)sulphonyl]pyridine
CID 13063498
2-Methylpyridine-3-sulfonamide
CID 22409057
3-(Morpholinosulfonyl)pyridine
CID 4276436
Pyridin-1-ium-3-sulfonate
CID 1549497
3-Sulfamoylpyridine 1-oxide
CID 12684277

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide?
The IUPAC name of N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide (CID 54276557) is N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide is O=S(=O)(NC(O)CF)c1cccnc1.
What is the InChIKey of N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide?
The InChIKey is RNUUQFISCVQQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O3S/c8-4-7(11)10-14(12,13)6-2-1-3-9-5-6/h1-3,5,7,10-11H,4H2.
What are the key properties of N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide?
N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide has a molecular weight of 220.22 g/mol, XLogP of -0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-1-hydroxyethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 54276557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).