N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide

C10H7FN4O2S — CID 82015244

IUPACN-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide
SMILESN#Cc1cc(F)ccc1NS(=O)(=O)c1cnc[nH]1
InChIInChI=1S/C10H7FN4O2S/c11-8-1-2-9(7(3-8)4-12)15-18(16,17)10-5-13-6-14-10/h1-3,5-6,15H,(H,13,14)
InChIKeyINLAOQVOQGVXIT-UHFFFAOYSA-N
MW266.26 g/mol
LogP1.22
Rot. Bonds3

About N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide

N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide (PubChem CID 82015244) has the molecular formula C10H7FN4O2S and a molecular weight of 266.26 g/mol. Its IUPAC name is N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide
PubChem CID82015244
Molecular FormulaC10H7FN4O2S
Molecular Weight266.26 g/mol
Exact Mass266.03
IUPAC NameN-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide
SMILESN#Cc1cc(F)ccc1NS(=O)(=O)c1cnc[nH]1
InChIInChI=1S/C10H7FN4O2S/c11-8-1-2-9(7(3-8)4-12)15-18(16,17)10-5-13-6-14-10/h1-3,5-6,15H,(H,13,14)
InChIKeyINLAOQVOQGVXIT-UHFFFAOYSA-N
XLogP1.22
TPSA98.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-(2-cyano-4-fluorophenyl)benzenesulfonamide
CID 82682816
2-chloro-N-(2-cyano-4-fluorophenyl)-5-fluorobenzenesulfonamide
CID 115972540
N-(2-cyano-4-fluorophenyl)-2-fluorobenzenesulfonamide
CID 82015576
2,5-dibromo-N-(2-cyano-4-fluorophenyl)benzenesulfonamide
CID 82684208
N-(2-cyano-4-fluorophenyl)-2,3-difluorobenzenesulfonamide
CID 75499452
N-(2-cyano-4-fluorophenyl)-1-phenylpyrazole-4-sulfonamide
CID 75522425
3-bromo-N-(2-cyano-4-fluorophenyl)thiophene-2-sulfonamide
CID 82016117
3-amino-N-(2-cyano-4-fluorophenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 105359179
N-(2-cyano-4-fluorophenyl)-2-methylpropane-1-sulfonamide
CID 82015245
2-cyano-1-(diethylsulfamoylamino)-4-fluorobenzene
CID 82015510
4-[(2-cyano-4-fluorophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 82013721
N-(2-hydroxy-4-methoxyphenyl)-1H-imidazole-5-sulfonamide
CID 102695858

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide (CID 82015244) is N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide is N#Cc1cc(F)ccc1NS(=O)(=O)c1cnc[nH]1.
What is the InChIKey of N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide?
The InChIKey is INLAOQVOQGVXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN4O2S/c11-8-1-2-9(7(3-8)4-12)15-18(16,17)10-5-13-6-14-10/h1-3,5-6,15H,(H,13,14).
What are the key properties of N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide?
N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide has a molecular weight of 266.26 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-4-fluorophenyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 82015244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).