3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide

C15H16FNO4S — CID 39825262

IUPAC3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cc(C)ccc2OC)cc1F
InChIInChI=1S/C15H16FNO4S/c1-10-4-6-15(21-3)13(8-10)17-22(18,19)11-5-7-14(20-2)12(16)9-11/h4-9,17H,1-3H3
InChIKeyGQBVZYVYPANNDA-UHFFFAOYSA-N
MW325.36 g/mol
LogP2.95
Rot. Bonds5

About 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide

3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide (PubChem CID 39825262) has the molecular formula C15H16FNO4S and a molecular weight of 325.36 g/mol. Its IUPAC name is 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide
PubChem CID39825262
Molecular FormulaC15H16FNO4S
Molecular Weight325.36 g/mol
Exact Mass325.08
IUPAC Name3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2cc(C)ccc2OC)cc1F
InChIInChI=1S/C15H16FNO4S/c1-10-4-6-15(21-3)13(8-10)17-22(18,19)11-5-7-14(20-2)12(16)9-11/h4-9,17H,1-3H3
InChIKeyGQBVZYVYPANNDA-UHFFFAOYSA-N
XLogP2.95
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.36
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide 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-(2-chloro-5-methyl-3-pyridinyl)-3-fluoro-4-methoxybenzenesulfonamide
CID 102976123
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
3-fluoro-4-methoxy-N-(3-methylphenyl)benzenesulfonamide
CID 19109258
3-fluoro-4-methoxy-N-(2,4,5-trichlorophenyl)benzenesulfonamide
CID 112811750
3-amino-N-(2-fluoro-4-methylphenyl)-4-methoxybenzenesulfonamide
CID 28890673
N-(2,5-dichlorophenyl)-3-fluoro-4-methoxybenzenesulfonamide
CID 19109274
N-(5-tert-butyl-2-methoxyphenyl)-3,4-difluorobenzenesulfonamide
CID 2106216
4-amino-N-(5-bromo-2-methoxyphenyl)-3-fluorobenzenesulfonamide
CID 82845895
3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide
CID 39825493
N-(2-fluoro-5-methylphenyl)-2-methoxy-5-methylbenzenesulfonamide
CID 8514842
N-(4-chlorophenyl)-3-fluoro-4-methoxybenzenesulfonamide
CID 19109264
3-fluoro-N-(2-methoxyphenyl)-4-propan-2-yloxybenzenesulfonamide
CID 110758242

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide?
The IUPAC name of 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide (CID 39825262) is 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide?
The canonical SMILES for 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2cc(C)ccc2OC)cc1F.
What is the InChIKey of 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide?
The InChIKey is GQBVZYVYPANNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO4S/c1-10-4-6-15(21-3)13(8-10)17-22(18,19)11-5-7-14(20-2)12(16)9-11/h4-9,17H,1-3H3.
What are the key properties of 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide?
3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide has a molecular weight of 325.36 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 39825262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).