N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide

C17H20N2O5S — CID 112999333

IUPACN-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccccc2C)cc1OC
InChIInChI=1S/C17H20N2O5S/c1-12-6-4-5-7-16(12)25(21,22)18-11-17(20)19-13-8-9-14(23-2)15(10-13)24-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyZEVNHWXXAPUZDZ-UHFFFAOYSA-N
MW364.42 g/mol
LogP1.93
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide

N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide (PubChem CID 112999333) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
PubChem CID112999333
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC NameN-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccccc2C)cc1OC
InChIInChI=1S/C17H20N2O5S/c1-12-6-4-5-7-16(12)25(21,22)18-11-17(20)19-13-8-9-14(23-2)15(10-13)24-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyZEVNHWXXAPUZDZ-UHFFFAOYSA-N
XLogP1.93
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-methylphenyl)sulfonylamino]-N-(3,4,5-trimethoxyphenyl)acetamide
CID 113000941
N-(3-chloro-4-methoxyphenyl)-2-[(2-chlorophenyl)sulfonylamino]acetamide
CID 112998391
N-(3,4-difluorophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 113002375
N-(3-acetamidophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112999723
N-(4-chlorophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112997960
N-(3,4-dimethoxyphenyl)-2-[(4-ethoxyphenyl)sulfonylamino]acetamide
CID 112999332
N-(4-acetylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112999662
N-(3,4-dimethylphenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 112996580
2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996215
2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
CID 112996092
N-(3,4-difluorophenyl)-2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]acetamide
CID 113002363
N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112999325

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide (CID 112999333) is N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide is COc1ccc(NC(=O)CNS(=O)(=O)c2ccccc2C)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide?
The InChIKey is ZEVNHWXXAPUZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-12-6-4-5-7-16(12)25(21,22)18-11-17(20)19-13-8-9-14(23-2)15(10-13)24-3/h4-10,18H,11H2,1-3H3,(H,19,20).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide?
N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide has a molecular weight of 364.42 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112999333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).