5-cyano-2-fluorobenzenesulfonamide

C7H5FN2O2S — CID 67530919

IUPAC5-cyano-2-fluorobenzenesulfonamide
SMILESN#Cc1ccc(F)c(S(N)(=O)=O)c1
InChIInChI=1S/C7H5FN2O2S/c8-6-2-1-5(4-9)3-7(6)13(10,11)12/h1-3H,(H2,10,11,12)
InChIKeyBDFCVHLHUQCCPU-UHFFFAOYSA-N
MW200.19 g/mol
LogP0.34
Rot. Bonds1

About 5-cyano-2-fluorobenzenesulfonamide

5-cyano-2-fluorobenzenesulfonamide (PubChem CID 67530919) has the molecular formula C7H5FN2O2S and a molecular weight of 200.19 g/mol. Its IUPAC name is 5-cyano-2-fluorobenzenesulfonamide.

Molecular Properties

Compound Name5-cyano-2-fluorobenzenesulfonamide
PubChem CID67530919
Molecular FormulaC7H5FN2O2S
Molecular Weight200.19 g/mol
Exact Mass200.01
IUPAC Name5-cyano-2-fluorobenzenesulfonamide
SMILESN#Cc1ccc(F)c(S(N)(=O)=O)c1
InChIInChI=1S/C7H5FN2O2S/c8-6-2-1-5(4-9)3-7(6)13(10,11)12/h1-3H,(H2,10,11,12)
InChIKeyBDFCVHLHUQCCPU-UHFFFAOYSA-N
XLogP0.34
TPSA83.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.19
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-2-fluorobenzenesulfonamide?
The IUPAC name of 5-cyano-2-fluorobenzenesulfonamide (CID 67530919) is 5-cyano-2-fluorobenzenesulfonamide.
What is the SMILES notation for 5-cyano-2-fluorobenzenesulfonamide?
The canonical SMILES for 5-cyano-2-fluorobenzenesulfonamide is N#Cc1ccc(F)c(S(N)(=O)=O)c1.
What is the InChIKey of 5-cyano-2-fluorobenzenesulfonamide?
The InChIKey is BDFCVHLHUQCCPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN2O2S/c8-6-2-1-5(4-9)3-7(6)13(10,11)12/h1-3H,(H2,10,11,12).
What are the key properties of 5-cyano-2-fluorobenzenesulfonamide?
5-cyano-2-fluorobenzenesulfonamide has a molecular weight of 200.19 g/mol, XLogP of 0.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-2-fluorobenzenesulfonamide is sourced from PubChem (CID 67530919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).