3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide

C7H7FN6O2S — CID 103299948

IUPAC3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
SMILESO=S(=O)(NCc1nn[nH]n1)c1ncccc1F
InChIInChI=1S/C7H7FN6O2S/c8-5-2-1-3-9-7(5)17(15,16)10-4-6-11-13-14-12-6/h1-3,10H,4H2,(H,11,12,13,14)
InChIKeyUAPUXGRKXDGIGX-UHFFFAOYSA-N
MW258.24 g/mol
LogP-0.79
Rot. Bonds4

About 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide

3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide (PubChem CID 103299948) has the molecular formula C7H7FN6O2S and a molecular weight of 258.24 g/mol. Its IUPAC name is 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
PubChem CID103299948
Molecular FormulaC7H7FN6O2S
Molecular Weight258.24 g/mol
Exact Mass258.03
IUPAC Name3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide
SMILESO=S(=O)(NCc1nn[nH]n1)c1ncccc1F
InChIInChI=1S/C7H7FN6O2S/c8-5-2-1-3-9-7(5)17(15,16)10-4-6-11-13-14-12-6/h1-3,10H,4H2,(H,11,12,13,14)
InChIKeyUAPUXGRKXDGIGX-UHFFFAOYSA-N
XLogP-0.79
TPSA113.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[({[6-(1h-Tetrazol-5-Yl)pyridin-3-Yl]sulfonyl}amino)methyl]boronic Acid
CID 71519580
3-(1H-tetrazol-5-yl)-[4,4''-bipyridine]-2-sulfonamide
CID 118265339
N-[(5-fluoro-2-pyridinyl)sulfonyl]-N-(methylamino)methanimidamide
CID 176937888
trihydroxy-[[[6-(2H-tetrazol-5-yl)-3-pyridinyl]sulfonylamino]methyl]boranuide
CID 60182326
5-fluoro-N-[1-(2H-tetrazol-5-yl)ethyl]pyridine-3-sulfonamide
CID 61853975
5-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-3-sulfonamide
CID 61854591
N-(2-aminoethyl)-3-fluoropyridine-2-sulfonamide
CID 103298465
N-[4-(aminomethyl)-1H-pyrazol-5-yl]-3-fluoropyridine-2-sulfonamide
CID 103298526
N-[4-(aminomethyl)-1-methylpyrazol-5-yl]-3-fluoropyridine-2-sulfonamide
CID 103298527
N-[4-(aminomethyl)-1-methylpyrazol-3-yl]-3-fluoropyridine-2-sulfonamide
CID 103298532
3-fluoro-N-(1,3,4-thiadiazol-2-yl)pyridine-2-sulfonamide
CID 103299156
3-fluoro-N-(1-methylpyrazol-3-yl)pyridine-2-sulfonamide
CID 103299283

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide (CID 103299948) is 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide is O=S(=O)(NCc1nn[nH]n1)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
The InChIKey is UAPUXGRKXDGIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN6O2S/c8-5-2-1-3-9-7(5)17(15,16)10-4-6-11-13-14-12-6/h1-3,10H,4H2,(H,11,12,13,14).
What are the key properties of 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide?
3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide has a molecular weight of 258.24 g/mol, XLogP of -0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2H-tetrazol-5-ylmethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103299948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).