5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide

C10H9ClFN3O2S — CID 43415160

IUPAC5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)Nc2ccccc2F)c1Cl
InChIInChI=1S/C10H9ClFN3O2S/c1-15-6-13-10(9(15)11)18(16,17)14-8-5-3-2-4-7(8)12/h2-6,14H,1H3
InChIKeySDXSFFRBUAASAE-UHFFFAOYSA-N
MW289.72 g/mol
LogP2.01
Rot. Bonds3

About 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide

5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide (PubChem CID 43415160) has the molecular formula C10H9ClFN3O2S and a molecular weight of 289.72 g/mol. Its IUPAC name is 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide
PubChem CID43415160
Molecular FormulaC10H9ClFN3O2S
Molecular Weight289.72 g/mol
Exact Mass289.01
IUPAC Name5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)Nc2ccccc2F)c1Cl
InChIInChI=1S/C10H9ClFN3O2S/c1-15-6-13-10(9(15)11)18(16,17)14-8-5-3-2-4-7(8)12/h2-6,14H,1H3
InChIKeySDXSFFRBUAASAE-UHFFFAOYSA-N
XLogP2.01
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415175
5-chloro-N-(2-fluoro-4-methylphenyl)-1-methylimidazole-4-sulfonamide
CID 43415195
5-chloro-N-(2,3-dichlorophenyl)-1-methylimidazole-4-sulfonamide
CID 43456018
5-chloro-1-methyl-N-(2-nitrophenyl)imidazole-4-sulfonamide
CID 61051631
N-(5-bromo-2,4-difluorophenyl)-5-chloro-1-methylimidazole-4-sulfonamide
CID 102846862
5-chloro-1-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)imidazole-4-sulfonamide
CID 43415193
5-chloro-N-(3,5-difluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415229
5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide
CID 55590040
5-chloro-1-methyl-N-naphthalen-2-ylimidazole-4-sulfonamide
CID 60747502
5-chloro-N-(5-chloro-2-cyanophenyl)-1-methylimidazole-4-sulfonamide
CID 61051415
5-chloro-1-methyl-N-pyridin-4-ylimidazole-4-sulfonamide
CID 43455993
5-chloro-1-methyl-N-(4-phenoxyphenyl)imidazole-4-sulfonamide
CID 46594182

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide?
The IUPAC name of 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide (CID 43415160) is 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide is Cn1cnc(S(=O)(=O)Nc2ccccc2F)c1Cl.
What is the InChIKey of 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide?
The InChIKey is SDXSFFRBUAASAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClFN3O2S/c1-15-6-13-10(9(15)11)18(16,17)14-8-5-3-2-4-7(8)12/h2-6,14H,1H3.
What are the key properties of 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide?
5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide has a molecular weight of 289.72 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 43415160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).