2-[(4-butylphenyl)sulfonylamino]benzamide

C17H20N2O3S — CID 3869387

IUPAC2-[(4-butylphenyl)sulfonylamino]benzamide
SMILESCCCCc1ccc(S(=O)(=O)Nc2ccccc2C(N)=O)cc1
InChIInChI=1S/C17H20N2O3S/c1-2-3-6-13-9-11-14(12-10-13)23(21,22)19-16-8-5-4-7-15(16)17(18)20/h4-5,7-12,19H,2-3,6H2,1H3,(H2,18,20)
InChIKeyBNWSUCFZYPUPJX-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.93
Rot. Bonds7

About 2-[(4-butylphenyl)sulfonylamino]benzamide

2-[(4-butylphenyl)sulfonylamino]benzamide (PubChem CID 3869387) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is 2-[(4-butylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name2-[(4-butylphenyl)sulfonylamino]benzamide
PubChem CID3869387
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name2-[(4-butylphenyl)sulfonylamino]benzamide
SMILESCCCCc1ccc(S(=O)(=O)Nc2ccccc2C(N)=O)cc1
InChIInChI=1S/C17H20N2O3S/c1-2-3-6-13-9-11-14(12-10-13)23(21,22)19-16-8-5-4-7-15(16)17(18)20/h4-5,7-12,19H,2-3,6H2,1H3,(H2,18,20)
InChIKeyBNWSUCFZYPUPJX-UHFFFAOYSA-N
XLogP2.93
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-butyl-N-(2-butylphenyl)benzenesulfonamide
CID 22774370
2-(butylsulfonylamino)benzamide
CID 17376030
methyl 4-[(2-carbamoylphenyl)sulfamoyl]benzoate
CID 17485240
5-[(4-butylphenyl)sulfamoyl]-2-chlorobenzamide
CID 78785926
4-butyl-N-(2-phenylsulfanylphenyl)benzenesulfonamide
CID 22202239
2-[2-[4-[(4-butylphenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 68690589
2-[(4-phenoxyphenyl)sulfonylamino]benzamide
CID 46763886
2-[(3,4-diethoxyphenyl)sulfonylamino]benzamide
CID 9055880
2-[(6-propoxynaphthalen-2-yl)sulfonylamino]benzamide
CID 91824604
2-[(4-butylphenyl)sulfonylamino]-5-[[4-(2-methoxyphenoxy)phenyl]sulfonylamino]benzoic acid
CID 45274237
4-butylbenzenesulfonohydrazide
CID 17255521
2-[(6-ethoxynaphthalen-2-yl)sulfonylamino]benzamide
CID 91824630

Frequently Asked Questions

What is the IUPAC name of 2-[(4-butylphenyl)sulfonylamino]benzamide?
The IUPAC name of 2-[(4-butylphenyl)sulfonylamino]benzamide (CID 3869387) is 2-[(4-butylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 2-[(4-butylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 2-[(4-butylphenyl)sulfonylamino]benzamide is CCCCc1ccc(S(=O)(=O)Nc2ccccc2C(N)=O)cc1.
What is the InChIKey of 2-[(4-butylphenyl)sulfonylamino]benzamide?
The InChIKey is BNWSUCFZYPUPJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-2-3-6-13-9-11-14(12-10-13)23(21,22)19-16-8-5-4-7-15(16)17(18)20/h4-5,7-12,19H,2-3,6H2,1H3,(H2,18,20).
What are the key properties of 2-[(4-butylphenyl)sulfonylamino]benzamide?
2-[(4-butylphenyl)sulfonylamino]benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.93, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-butylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 3869387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).