N-(3-fluoropyrazin-2-yl)benzenesulfonamide

C10H8FN3O2S — CID 67234341

IUPACN-(3-fluoropyrazin-2-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1nccnc1F)c1ccccc1
InChIInChI=1S/C10H8FN3O2S/c11-9-10(13-7-6-12-9)14-17(15,16)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChIKeyKDXZOTYTDLCBAR-UHFFFAOYSA-N
MW253.26 g/mol
LogP1.42
Rot. Bonds3

About N-(3-fluoropyrazin-2-yl)benzenesulfonamide

N-(3-fluoropyrazin-2-yl)benzenesulfonamide (PubChem CID 67234341) has the molecular formula C10H8FN3O2S and a molecular weight of 253.26 g/mol. Its IUPAC name is N-(3-fluoropyrazin-2-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(3-fluoropyrazin-2-yl)benzenesulfonamide
PubChem CID67234341
Molecular FormulaC10H8FN3O2S
Molecular Weight253.26 g/mol
Exact Mass253.03
IUPAC NameN-(3-fluoropyrazin-2-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1nccnc1F)c1ccccc1
InChIInChI=1S/C10H8FN3O2S/c11-9-10(13-7-6-12-9)14-17(15,16)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChIKeyKDXZOTYTDLCBAR-UHFFFAOYSA-N
XLogP1.42
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoropyrazin-2-yl)benzenesulfonamide?
The IUPAC name of N-(3-fluoropyrazin-2-yl)benzenesulfonamide (CID 67234341) is N-(3-fluoropyrazin-2-yl)benzenesulfonamide.
What is the SMILES notation for N-(3-fluoropyrazin-2-yl)benzenesulfonamide?
The canonical SMILES for N-(3-fluoropyrazin-2-yl)benzenesulfonamide is O=S(=O)(Nc1nccnc1F)c1ccccc1.
What is the InChIKey of N-(3-fluoropyrazin-2-yl)benzenesulfonamide?
The InChIKey is KDXZOTYTDLCBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O2S/c11-9-10(13-7-6-12-9)14-17(15,16)8-4-2-1-3-5-8/h1-7H,(H,13,14).
What are the key properties of N-(3-fluoropyrazin-2-yl)benzenesulfonamide?
N-(3-fluoropyrazin-2-yl)benzenesulfonamide has a molecular weight of 253.26 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoropyrazin-2-yl)benzenesulfonamide is sourced from PubChem (CID 67234341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).