N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide

C17H20N2O4S — CID 25400706

IUPACN-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-12(2)19-24(21,22)16-10-4-13(5-11-16)17(20)18-14-6-8-15(23-3)9-7-14/h4-12,19H,1-3H3,(H,18,20)
InChIKeyYZJMEIPXSVTWSV-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.63
Rot. Bonds6

About N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide

N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide (PubChem CID 25400706) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
PubChem CID25400706
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-12(2)19-24(21,22)16-10-4-13(5-11-16)17(20)18-14-6-8-15(23-3)9-7-14/h4-12,19H,1-3H3,(H,18,20)
InChIKeyYZJMEIPXSVTWSV-UHFFFAOYSA-N
XLogP2.63
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[[4-[(4-methoxybenzoyl)amino]phenyl]sulfonylamino]-3-methylbutanoic acid
CID 10363964
4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 17353518
N-(4-acetamidophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 27648936
4-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 4924513
2-(4-methoxyphenyl)-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 2222071
4-(ethylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 9411925
N-(4-cyanophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 26698371
N-(4-methoxyphenyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 19258037
N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]-2-methylpropanamide
CID 26965582
N-[(4-methoxyphenyl)-phenylmethyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 16600285
N-[4-(propan-2-ylsulfamoyl)phenyl]-1H-pyrazole-4-carboxamide
CID 61260747
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide (CID 25400706) is N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide is COc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The InChIKey is YZJMEIPXSVTWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-12(2)19-24(21,22)16-10-4-13(5-11-16)17(20)18-14-6-8-15(23-3)9-7-14/h4-12,19H,1-3H3,(H,18,20).
What are the key properties of N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide?
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 25400706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).