N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide

C17H19FN2O4S — CID 17455377

IUPACN-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1
InChIInChI=1S/C17H19FN2O4S/c1-12-3-6-14(11-16(12)18)20-17(21)13-4-7-15(8-5-13)25(22,23)19-9-10-24-2/h3-8,11,19H,9-10H2,1-2H3,(H,20,21)
InChIKeyXHHQRQCLBZZDBD-UHFFFAOYSA-N
MW366.41 g/mol
LogP2.31
Rot. Bonds7

About N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide

N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide (PubChem CID 17455377) has the molecular formula C17H19FN2O4S and a molecular weight of 366.41 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
PubChem CID17455377
Molecular FormulaC17H19FN2O4S
Molecular Weight366.41 g/mol
Exact Mass366.10
IUPAC NameN-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1
InChIInChI=1S/C17H19FN2O4S/c1-12-3-6-14(11-16(12)18)20-17(21)13-4-7-15(8-5-13)25(22,23)19-9-10-24-2/h3-8,11,19H,9-10H2,1-2H3,(H,20,21)
InChIKeyXHHQRQCLBZZDBD-UHFFFAOYSA-N
XLogP2.31
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chloro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 17485467
N-(3-fluoro-4-methylphenyl)-4-(prop-2-ynylsulfamoyl)benzamide
CID 33314755
4-(2-methoxyethylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 35437620
4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-(3-fluoro-4-methylphenyl)benzamide
CID 34228029
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 24625442
4-(2-methoxyethylsulfamoyl)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 24584227
4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide
CID 109059796
N-(4-ethoxyphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 34677141
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 46467570
N-(3,4-difluorophenyl)-4-[2-(dimethylamino)ethylsulfamoyl]benzamide
CID 109060210
N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
CID 9416096
2-fluoro-N-(3-fluoro-4-methylphenyl)-5-(propylsulfamoyl)benzamide
CID 25038796

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide (CID 17455377) is N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide is COCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide?
The InChIKey is XHHQRQCLBZZDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O4S/c1-12-3-6-14(11-16(12)18)20-17(21)13-4-7-15(8-5-13)25(22,23)19-9-10-24-2/h3-8,11,19H,9-10H2,1-2H3,(H,20,21).
What are the key properties of N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide?
N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide has a molecular weight of 366.41 g/mol, XLogP of 2.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide is sourced from PubChem (CID 17455377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).