2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide

C17H18F2N2O4S — CID 34174804

IUPAC2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1
InChIInChI=1S/C17H18F2N2O4S/c1-2-11-20-26(23,24)13-9-7-12(8-10-13)21-16(22)14-5-3-4-6-15(14)25-17(18)19/h3-10,17,20H,2,11H2,1H3,(H,21,22)
InChIKeyMJJXPAHHKUZWSA-UHFFFAOYSA-N
MW384.40 g/mol
LogP3.23
Rot. Bonds8

About 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide

2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide (PubChem CID 34174804) has the molecular formula C17H18F2N2O4S and a molecular weight of 384.40 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
PubChem CID34174804
Molecular FormulaC17H18F2N2O4S
Molecular Weight384.40 g/mol
Exact Mass384.10
IUPAC Name2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1
InChIInChI=1S/C17H18F2N2O4S/c1-2-11-20-26(23,24)13-9-7-12(8-10-13)21-16(22)14-5-3-4-6-15(14)25-17(18)19/h3-10,17,20H,2,11H2,1H3,(H,21,22)
InChIKeyMJJXPAHHKUZWSA-UHFFFAOYSA-N
XLogP3.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.40
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-phenoxyethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4954384
N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
CID 17225015
2-methoxy-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 4932985
2-(difluoromethoxy)-N-propylbenzamide
CID 60654909
2-bromo-N-[4-(butylsulfamoyl)phenyl]benzamide
CID 2162853
2-(difluoromethoxy)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 39977055
2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 38352115
N-[4-(butylsulfamoyl)phenyl]-2-methylbenzamide
CID 4278982
2,6-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17146819
N-[3-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)benzamide
CID 8883724
(4-chlorophenyl)-[4-[[2-(difluoromethoxy)benzoyl]amino]phenyl]sulfonylazanide
CID 4748446
2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 26904916

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide (CID 34174804) is 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide is CCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1.
What is the InChIKey of 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide?
The InChIKey is MJJXPAHHKUZWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N2O4S/c1-2-11-20-26(23,24)13-9-7-12(8-10-13)21-16(22)14-5-3-4-6-15(14)25-17(18)19/h3-10,17,20H,2,11H2,1H3,(H,21,22).
What are the key properties of 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide?
2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide has a molecular weight of 384.40 g/mol, XLogP of 3.23, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 34174804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).