2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide

C22H22N2O4S — CID 2208349

IUPAC2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccccc1N(C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-16-13-14-21(28-3)19(15-16)23-22(25)18-11-7-8-12-20(18)24(2)29(26,27)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,23,25)
InChIKeyHFPFQRRQNUBBQD-UHFFFAOYSA-N
MW410.50 g/mol
LogP4.08
Rot. Bonds6

About 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide

2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide (PubChem CID 2208349) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide
PubChem CID2208349
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccccc1N(C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C22H22N2O4S/c1-16-13-14-21(28-3)19(15-16)23-22(25)18-11-7-8-12-20(18)24(2)29(26,27)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,23,25)
InChIKeyHFPFQRRQNUBBQD-UHFFFAOYSA-N
XLogP4.08
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(Cyclopropanesulfonamido)-N-(2-ethoxyphenyl)benzamide
CID 71598556
2-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-N-hydroxy-3-hydroxycarbamoylmethoxy-benzamide
CID 44316333
N-(2-methoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2083341
N-[1-(4-methoxy-benzenesulfonyl)-2,3-dihydro-1H-indol-7-yl]-benzamide
CID 25168005
Sulfonamide-01
CID 11532283
N-(2-methoxy-5-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)benzamide
CID 2987883
3-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-(2-methoxyphenyl)propanamide
CID 1317129
N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2116569
N-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide
CID 2463208
Ethyl 2-[[2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)acetyl]amino]benzoate
CID 2513657
4-[(2-methoxyphenyl)sulfamoyl]-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 2519306
2-anilino-N-(2-methoxyphenyl)benzamide
CID 4568699

Frequently Asked Questions

What is the IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide?
The IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide (CID 2208349) is 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide.
What is the SMILES notation for 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide?
The canonical SMILES for 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide is COc1ccc(C)cc1NC(=O)c1ccccc1N(C)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide?
The InChIKey is HFPFQRRQNUBBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-16-13-14-21(28-3)19(15-16)23-22(25)18-11-7-8-12-20(18)24(2)29(26,27)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,23,25).
What are the key properties of 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide?
2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide has a molecular weight of 410.50 g/mol, XLogP of 4.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzenesulfonyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)benzamide is sourced from PubChem (CID 2208349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).