2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide

C15H15BrN2O3S — CID 24502280

IUPAC2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1C
InChIInChI=1S/C15H15BrN2O3S/c1-10-7-8-11(16)9-14(10)22(20,21)18-13-6-4-3-5-12(13)15(19)17-2/h3-9,18H,1-2H3,(H,17,19)
InChIKeyMCCSKWPRRFYTIR-UHFFFAOYSA-N
MW383.27 g/mol
LogP2.92
Rot. Bonds4

About 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide

2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide (PubChem CID 24502280) has the molecular formula C15H15BrN2O3S and a molecular weight of 383.27 g/mol. Its IUPAC name is 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound Name2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
PubChem CID24502280
Molecular FormulaC15H15BrN2O3S
Molecular Weight383.27 g/mol
Exact Mass382.00
IUPAC Name2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1C
InChIInChI=1S/C15H15BrN2O3S/c1-10-7-8-11(16)9-14(10)22(20,21)18-13-6-4-3-5-12(13)15(19)17-2/h3-9,18H,1-2H3,(H,17,19)
InChIKeyMCCSKWPRRFYTIR-UHFFFAOYSA-N
XLogP2.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.27
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-bromo-2-methylphenyl)sulfonylamino]benzamide
CID 17412326
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 26268702
2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 25331442
N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 3581351
2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide
CID 43576281
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylbenzamide
CID 26268701
5-bromo-N-(2-cyanophenyl)-2-methylbenzenesulfonamide
CID 8513690
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
CID 35990783
5-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methyl-1H-indole-2-carboxamide
CID 166221467
5-bromo-N-(2,3-difluorophenyl)-2-methylbenzenesulfonamide
CID 47336995
N-(3,5-dichlorophenyl)-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
CID 2333532
N-(5-bromo-2-methylphenyl)-2-(methylamino)benzenesulfonamide
CID 62146330

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide?
The IUPAC name of 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide (CID 24502280) is 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide.
What is the SMILES notation for 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide?
The canonical SMILES for 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide is CNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1C.
What is the InChIKey of 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide?
The InChIKey is MCCSKWPRRFYTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3S/c1-10-7-8-11(16)9-14(10)22(20,21)18-13-6-4-3-5-12(13)15(19)17-2/h3-9,18H,1-2H3,(H,17,19).
What are the key properties of 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide?
2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide has a molecular weight of 383.27 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 24502280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).