N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide

C17H20N2O4S — CID 109061946

IUPACN-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide
SMILESCCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(OC)cc2)c1
InChIInChI=1S/C17H20N2O4S/c1-3-11-18-24(21,22)16-6-4-5-13(12-16)17(20)19-14-7-9-15(23-2)10-8-14/h4-10,12,18H,3,11H2,1-2H3,(H,19,20)
InChIKeyOTGHYNPCQHQWDU-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.64
Rot. Bonds7

About N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide

N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide (PubChem CID 109061946) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide
PubChem CID109061946
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide
SMILESCCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(OC)cc2)c1
InChIInChI=1S/C17H20N2O4S/c1-3-11-18-24(21,22)16-6-4-5-13(12-16)17(20)19-14-7-9-15(23-2)10-8-14/h4-10,12,18H,3,11H2,1-2H3,(H,19,20)
InChIKeyOTGHYNPCQHQWDU-UHFFFAOYSA-N
XLogP2.64
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[3-(propylsulfamoyl)benzoyl]amino]benzoate
CID 109061963
N-(3,5-dimethylphenyl)-3-(propylsulfamoyl)benzamide
CID 109061917
3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide
CID 55565688
3-(2-methoxyethylsulfamoyl)-N-phenylbenzamide
CID 6463975
4-[[3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 6611513
[2-(4-methoxyphenyl)-2-oxoethyl] 3-(propylsulfamoyl)benzoate
CID 7536992
N-(2,6-dimethylphenyl)-3-(propylsulfamoyl)benzamide
CID 109061918
3-butan-2-yloxy-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17149776
N-(3-methoxyphenyl)-3-(3-methylbutylsulfamoyl)benzamide
CID 109065294
N-[4-(dimethylamino)phenyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063603
N-(2,4-dimethoxyphenyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063596
N-[4-(2-methoxyethoxy)phenyl]-3-(prop-2-enylsulfamoyl)benzamide
CID 46442034

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide?
The IUPAC name of N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide (CID 109061946) is N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide?
The canonical SMILES for N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide is CCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(OC)cc2)c1.
What is the InChIKey of N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide?
The InChIKey is OTGHYNPCQHQWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-11-18-24(21,22)16-6-4-5-13(12-16)17(20)19-14-7-9-15(23-2)10-8-14/h4-10,12,18H,3,11H2,1-2H3,(H,19,20).
What are the key properties of N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide?
N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide is sourced from PubChem (CID 109061946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).