2-[(2-propylsulfonylbenzoyl)amino]benzamide

C17H18N2O4S — CID 17224890

IUPAC2-[(2-propylsulfonylbenzoyl)amino]benzamide
SMILESCCCS(=O)(=O)c1ccccc1C(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C17H18N2O4S/c1-2-11-24(22,23)15-10-6-4-8-13(15)17(21)19-14-9-5-3-7-12(14)16(18)20/h3-10H,2,11H2,1H3,(H2,18,20)(H,19,21)
InChIKeyMCLPXXZAPYAIIR-UHFFFAOYSA-N
MW346.41 g/mol
LogP2.22
Rot. Bonds6

About 2-[(2-propylsulfonylbenzoyl)amino]benzamide

2-[(2-propylsulfonylbenzoyl)amino]benzamide (PubChem CID 17224890) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is 2-[(2-propylsulfonylbenzoyl)amino]benzamide.

Molecular Properties

Compound Name2-[(2-propylsulfonylbenzoyl)amino]benzamide
PubChem CID17224890
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC Name2-[(2-propylsulfonylbenzoyl)amino]benzamide
SMILESCCCS(=O)(=O)c1ccccc1C(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C17H18N2O4S/c1-2-11-24(22,23)15-10-6-4-8-13(15)17(21)19-14-9-5-3-7-12(14)16(18)20/h3-10H,2,11H2,1H3,(H2,18,20)(H,19,21)
InChIKeyMCLPXXZAPYAIIR-UHFFFAOYSA-N
XLogP2.22
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(ethylamino)benzoyl]amino]benzamide
CID 63107722
N-(4-acetamidophenyl)-2-propylsulfonylbenzamide
CID 17224883
N-(2,4-difluorophenyl)-2-propylsulfonylbenzamide
CID 17224852
N-(2-amino-2-methylpropyl)-2-propylsulfonylbenzamide;hydrochloride
CID 119629136
2-[(2-ethylsulfanylbenzoyl)amino]benzamide
CID 4631713
2-propylsulfonyl-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55678185
1-methyl-3-(2-propylsulfonylphenyl)urea
CID 117061578
dimethyl 2-[(2-propylsulfonylbenzoyl)amino]benzene-1,4-dicarboxylate
CID 17224739
N-(5-acetamido-2-chlorophenyl)-2-propylsulfonylbenzamide
CID 55916096
propyl 4-[(2-propylsulfonylbenzoyl)amino]benzoate
CID 17224802
2-[(2-propylsulfonylbenzoyl)amino]acetic acid
CID 119171610
N-ethyl-2-propylsulfonylaniline
CID 43453634

Frequently Asked Questions

What is the IUPAC name of 2-[(2-propylsulfonylbenzoyl)amino]benzamide?
The IUPAC name of 2-[(2-propylsulfonylbenzoyl)amino]benzamide (CID 17224890) is 2-[(2-propylsulfonylbenzoyl)amino]benzamide.
What is the SMILES notation for 2-[(2-propylsulfonylbenzoyl)amino]benzamide?
The canonical SMILES for 2-[(2-propylsulfonylbenzoyl)amino]benzamide is CCCS(=O)(=O)c1ccccc1C(=O)Nc1ccccc1C(N)=O.
What is the InChIKey of 2-[(2-propylsulfonylbenzoyl)amino]benzamide?
The InChIKey is MCLPXXZAPYAIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4S/c1-2-11-24(22,23)15-10-6-4-8-13(15)17(21)19-14-9-5-3-7-12(14)16(18)20/h3-10H,2,11H2,1H3,(H2,18,20)(H,19,21).
What are the key properties of 2-[(2-propylsulfonylbenzoyl)amino]benzamide?
2-[(2-propylsulfonylbenzoyl)amino]benzamide has a molecular weight of 346.41 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-propylsulfonylbenzoyl)amino]benzamide is sourced from PubChem (CID 17224890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).