4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide

C17H19FN2O4S — CID 9411896

IUPAC4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(NC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O4S/c1-24-15-8-6-14(7-9-15)20-17(21)3-2-12-19-25(22,23)16-10-4-13(18)5-11-16/h4-11,19H,2-3,12H2,1H3,(H,20,21)
InChIKeyBBGXYTMUMAUHKD-UHFFFAOYSA-N
MW366.41 g/mol
LogP2.53
Rot. Bonds8

About 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide

4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide (PubChem CID 9411896) has the molecular formula C17H19FN2O4S and a molecular weight of 366.41 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide.

Molecular Properties

Compound Name4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
PubChem CID9411896
Molecular FormulaC17H19FN2O4S
Molecular Weight366.41 g/mol
Exact Mass366.10
IUPAC Name4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
SMILESCOc1ccc(NC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O4S/c1-24-15-8-6-14(7-9-15)20-17(21)3-2-12-19-25(22,23)16-10-4-13(18)5-11-16/h4-11,19H,2-3,12H2,1H3,(H,20,21)
InChIKeyBBGXYTMUMAUHKD-UHFFFAOYSA-N
XLogP2.53
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide 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

3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 17192102
N-(4-ethoxyphenyl)-4-[(4-fluorophenyl)sulfonylamino]butanamide
CID 9410697
4-[(4-fluorophenyl)sulfonylamino]-N-[4-(methylsulfamoyl)phenyl]butanamide
CID 24635402
N-(4-fluorophenyl)-4-(4-methoxyphenyl)sulfonylbutanamide
CID 41273900
N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192669
N-[4-(diethylsulfamoyl)phenyl]-4-[(4-fluorophenyl)sulfonylamino]butanamide
CID 24640292
N-[4-(butylsulfamoyl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 17310703
3-[(4-fluorophenyl)sulfonylamino]-N-[4-(hexylsulfamoyl)phenyl]propanamide
CID 17192252
N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192589
N-[4-(cyanomethyl)phenyl]-4-[(4-fluorophenyl)sulfonylamino]butanamide
CID 9260809
3-[(4-fluorophenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 9452229
3-[(4-methoxyphenyl)sulfonylamino]-N-pyridin-4-ylpropanamide
CID 17192611

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide?
The IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide (CID 9411896) is 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide.
What is the SMILES notation for 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide?
The canonical SMILES for 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide is COc1ccc(NC(=O)CCCNS(=O)(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide?
The InChIKey is BBGXYTMUMAUHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O4S/c1-24-15-8-6-14(7-9-15)20-17(21)3-2-12-19-25(22,23)16-10-4-13(18)5-11-16/h4-11,19H,2-3,12H2,1H3,(H,20,21).
What are the key properties of 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide?
4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide has a molecular weight of 366.41 g/mol, XLogP of 2.53, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide is sourced from PubChem (CID 9411896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).