N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide

C11H11FN4O3S — CID 103511933

IUPACN-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide
SMILESCn1cncc1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C11H11FN4O3S/c1-16-6-14-5-9(16)11(17)15-8-4-7(12)2-3-10(8)20(13,18)19/h2-6H,1H3,(H,15,17)(H2,13,18,19)
InChIKeyLRYSPGAMMPLNAS-UHFFFAOYSA-N
MW298.30 g/mol
LogP0.46
Rot. Bonds3

About N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide

N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide (PubChem CID 103511933) has the molecular formula C11H11FN4O3S and a molecular weight of 298.30 g/mol. Its IUPAC name is N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide
PubChem CID103511933
Molecular FormulaC11H11FN4O3S
Molecular Weight298.30 g/mol
Exact Mass298.05
IUPAC NameN-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide
SMILESCn1cncc1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C11H11FN4O3S/c1-16-6-14-5-9(16)11(17)15-8-4-7(12)2-3-10(8)20(13,18)19/h2-6H,1H3,(H,15,17)(H2,13,18,19)
InChIKeyLRYSPGAMMPLNAS-UHFFFAOYSA-N
XLogP0.46
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromo-4-sulfamoylphenyl)-3-methylimidazole-4-carboxamide
CID 103511171
methyl 2-[[4-fluoro-2-[(3-methylimidazole-4-carbonyl)amino]benzoyl]amino]propanoate
CID 166225265
N-(5-fluoro-2-sulfamoylphenyl)thiadiazole-5-carboxamide
CID 65215733
N-(5-fluoro-2-sulfamoylphenyl)-4-iodobenzamide
CID 61130930
N-(2,6-difluoro-3-pyridinyl)-3-methylimidazole-4-carboxamide
CID 103512452
4,5-difluoro-2-[(3-methylimidazole-4-carbonyl)amino]benzoic acid
CID 103510522
N-(5-fluoro-2-sulfamoylphenyl)-2-(1,2,4-triazol-1-yl)acetamide
CID 61130568
N-(5-fluoro-2-sulfamoylphenyl)butanamide
CID 61130555
4-bromo-3-[(3-methylimidazole-4-carbonyl)amino]benzoic acid
CID 114003854
N-(4-bromo-2-methylphenyl)-3-methylimidazole-4-carboxamide
CID 110863038
4-bromo-N-(5-fluoro-2-sulfamoylphenyl)-1H-pyrrole-2-carboxamide
CID 61130923
N-(5-fluoro-2-sulfamoylphenyl)hexanamide
CID 61131111

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide?
The IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide (CID 103511933) is N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide?
The canonical SMILES for N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide is Cn1cncc1C(=O)Nc1cc(F)ccc1S(N)(=O)=O.
What is the InChIKey of N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide?
The InChIKey is LRYSPGAMMPLNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O3S/c1-16-6-14-5-9(16)11(17)15-8-4-7(12)2-3-10(8)20(13,18)19/h2-6H,1H3,(H,15,17)(H2,13,18,19).
What are the key properties of N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide?
N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide has a molecular weight of 298.30 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-sulfamoylphenyl)-3-methylimidazole-4-carboxamide is sourced from PubChem (CID 103511933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).