N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide

C17H20N2O4S — CID 60579365

IUPACN-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)c(NS(=O)(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H20N2O4S/c1-11-5-8-17(12(2)9-11)24(21,22)19-16-10-14(23-4)6-7-15(16)18-13(3)20/h5-10,19H,1-4H3,(H,18,20)
InChIKeyNPNZNMWVPOCHKY-UHFFFAOYSA-N
MW348.42 g/mol
LogP3.07
Rot. Bonds5

About N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide

N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide (PubChem CID 60579365) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
PubChem CID60579365
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)c(NS(=O)(=O)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H20N2O4S/c1-11-5-8-17(12(2)9-11)24(21,22)19-16-10-14(23-4)6-7-15(16)18-13(3)20/h5-10,19H,1-4H3,(H,18,20)
InChIKeyNPNZNMWVPOCHKY-UHFFFAOYSA-N
XLogP3.07
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2,5-dimethylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
CID 113093007
[4-[(4-methoxy-2-methylphenyl)sulfonylamino]phenyl]urea
CID 47062796
N-(2-bromo-4-methylphenyl)-2,4-dimethoxybenzenesulfonamide
CID 22773975
N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide
CID 62997670
3-[(2,4-dimethylphenyl)sulfamoyl]-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 126415722
N-(2-bromo-5-methylphenyl)-2,4-dimethylbenzenesulfonamide
CID 82757244
2-tert-butyl-N-[4-methoxy-2-(2,2,2-trifluoroacetyl)phenyl]-4-methylbenzenesulfonamide
CID 175545105
N-(5-methoxy-2-methylphenyl)-4-methylbenzenesulfonamide
CID 5146130
N-(4-amino-2-methylphenyl)-2,4-dimethylbenzenesulfonamide
CID 43120010
N-(2,4-dimethoxyphenyl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 113098643
1-(2,4-dimethylphenyl)-3-[2-[(4-ethoxyphenyl)sulfamoyl]-4-methoxyphenyl]thiourea
CID 25039010
(2S)-N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-2-(4-methylphenoxy)propanamide
CID 40785964

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide?
The IUPAC name of N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide (CID 60579365) is N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide.
What is the SMILES notation for N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide?
The canonical SMILES for N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide is COc1ccc(NC(C)=O)c(NS(=O)(=O)c2ccc(C)cc2C)c1.
What is the InChIKey of N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide?
The InChIKey is NPNZNMWVPOCHKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-11-5-8-17(12(2)9-11)24(21,22)19-16-10-14(23-4)6-7-15(16)18-13(3)20/h5-10,19H,1-4H3,(H,18,20).
What are the key properties of N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide?
N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide has a molecular weight of 348.42 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2,4-dimethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide is sourced from PubChem (CID 60579365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).