N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide

C20H26N2O4S — CID 17142416

IUPACN-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-12-10-17(11-13-19)21-20(23)16-8-7-9-18(14-16)26-15(3)4/h7-15H,5-6H2,1-4H3,(H,21,23)
InChIKeySENMUIMXXJOJHC-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.76
Rot. Bonds8

About N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide

N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide (PubChem CID 17142416) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide
PubChem CID17142416
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-12-10-17(11-13-19)21-20(23)16-8-7-9-18(14-16)26-15(3)4/h7-15H,5-6H2,1-4H3,(H,21,23)
InChIKeySENMUIMXXJOJHC-UHFFFAOYSA-N
XLogP3.76
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-3-ethoxybenzamide
CID 4957423
N-[4-(diethylsulfamoyl)phenyl]-3-fluorobenzamide
CID 3643564
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
3-(diethylsulfamoyl)-N-(4-ethylphenyl)benzamide
CID 2684396
N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]-4-propan-2-yloxybenzamide
CID 4952219
3-propan-2-yloxy-N-[4-[[4-[(3-propan-2-yloxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 17142916
[3-[(3-methoxybenzoyl)amino]phenyl] 3-(diethylsulfamoyl)benzoate
CID 1250260
N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-(difluoromethoxy)benzamide
CID 26521263
N-[4-[ethyl(phenyl)sulfamoyl]phenyl]-3-(2-methylpropoxy)benzamide
CID 17140257
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-(difluoromethoxy)benzamide
CID 7948721

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide (CID 17142416) is N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cccc(OC(C)C)c2)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide?
The InChIKey is SENMUIMXXJOJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-12-10-17(11-13-19)21-20(23)16-8-7-9-18(14-16)26-15(3)4/h7-15H,5-6H2,1-4H3,(H,21,23).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide?
N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide has a molecular weight of 390.51 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-3-propan-2-yloxybenzamide is sourced from PubChem (CID 17142416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).