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

C10H10FN3O2S — CID 62998345

IUPACN-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccc(F)cc2)[nH]1
InChIInChI=1S/C10H10FN3O2S/c1-7-12-6-10(13-7)17(15,16)14-9-4-2-8(11)3-5-9/h2-6,14H,1H3,(H,12,13)
InChIKeyCUQUQQTUWOCZSW-UHFFFAOYSA-N
MW255.27 g/mol
LogP1.66
Rot. Bonds3

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

N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide (PubChem CID 62998345) has the molecular formula C10H10FN3O2S and a molecular weight of 255.27 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
PubChem CID62998345
Molecular FormulaC10H10FN3O2S
Molecular Weight255.27 g/mol
Exact Mass255.05
IUPAC NameN-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccc(F)cc2)[nH]1
InChIInChI=1S/C10H10FN3O2S/c1-7-12-6-10(13-7)17(15,16)14-9-4-2-8(11)3-5-9/h2-6,14H,1H3,(H,12,13)
InChIKeyCUQUQQTUWOCZSW-UHFFFAOYSA-N
XLogP1.66
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
CID 62997996
N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62997984
2-methyl-N-quinoxalin-6-yl-1H-imidazole-5-sulfonamide
CID 63000218
N-(3-hydroxy-4-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64794398
N'-hydroxy-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzenecarboximidamide
CID 77021130
2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 63000163
N-(3-chloro-4-hydroxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64786558
2-methyl-N-[3-(trifluoromethyl)phenyl]-1H-imidazole-5-sulfonamide
CID 62998902
N-(3-bromo-4-methoxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 63999221
N-(2,6-dibromophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 104922595
2-chloro-5-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzamide
CID 63000377
2-methyl-N-(2,4,6-trimethylphenyl)-1H-imidazole-5-sulfonamide
CID 62999451

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide (CID 62998345) is N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2ccc(F)cc2)[nH]1.
What is the InChIKey of N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The InChIKey is CUQUQQTUWOCZSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O2S/c1-7-12-6-10(13-7)17(15,16)14-9-4-2-8(11)3-5-9/h2-6,14H,1H3,(H,12,13).
What are the key properties of N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide?
N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide has a molecular weight of 255.27 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 62998345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).