N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide

C18H22N2O3S — CID 22774827

IUPACN-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide
SMILESCCCCc1ccc(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-3-4-5-15-6-12-18(13-7-15)24(22,23)20-17-10-8-16(9-11-17)19-14(2)21/h6-13,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyOEBCKRRBXAMODM-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.79
Rot. Bonds7

About N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide

N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 22774827) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide
PubChem CID22774827
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC NameN-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide
SMILESCCCCc1ccc(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-3-4-5-15-6-12-18(13-7-15)24(22,23)20-17-10-8-16(9-11-17)19-14(2)21/h6-13,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyOEBCKRRBXAMODM-UHFFFAOYSA-N
XLogP3.79
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(4-butylphenyl)sulfonylamino]phenyl]acetamide
CID 17388137
N-[4-[(4-ethylphenyl)sulfamoyl]phenyl]acetamide
CID 798958
3-[4-[(4-acetamidophenyl)sulfonylamino]phenyl]propanoic acid
CID 17341594
4-(benzenesulfonamido)-N-(4-butylphenyl)benzamide
CID 2231369
1-(4-butylphenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]thiourea
CID 19678912
4-butyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]benzenesulfonamide
CID 19683735
N-[4-[[4-(propylsulfamoyl)phenyl]sulfamoyl]phenyl]acetamide
CID 2134216
2-[2-[4-[(4-butylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 68690589
3-[2-[4-[(4-butylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 68688780
N-[4-[(4-propylphenyl)methylsulfamoyl]phenyl]acetamide
CID 110780438
1-(4-butylphenyl)-3-(4-methylphenyl)sulfonylurea
CID 3515825
5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoate
CID 7040597

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide (CID 22774827) is N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide is CCCCc1ccc(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is OEBCKRRBXAMODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-3-4-5-15-6-12-18(13-7-15)24(22,23)20-17-10-8-16(9-11-17)19-14(2)21/h6-13,20H,3-5H2,1-2H3,(H,19,21).
What are the key properties of N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide?
N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 346.45 g/mol, XLogP of 3.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 22774827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).