N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide

C17H19FN2O5S — CID 112999196

IUPACN-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(OC)c(NC(=O)CNS(=O)(=O)c2ccc(F)c(C)c2)c1
InChIInChI=1S/C17H19FN2O5S/c1-11-8-13(5-6-14(11)18)26(22,23)19-10-17(21)20-15-9-12(24-2)4-7-16(15)25-3/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyLJZYSKOOHUSAJT-UHFFFAOYSA-N
MW382.41 g/mol
LogP2.07
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide

N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide (PubChem CID 112999196) has the molecular formula C17H19FN2O5S and a molecular weight of 382.41 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
PubChem CID112999196
Molecular FormulaC17H19FN2O5S
Molecular Weight382.41 g/mol
Exact Mass382.10
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(OC)c(NC(=O)CNS(=O)(=O)c2ccc(F)c(C)c2)c1
InChIInChI=1S/C17H19FN2O5S/c1-11-8-13(5-6-14(11)18)26(22,23)19-10-17(21)20-15-9-12(24-2)4-7-16(15)25-3/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyLJZYSKOOHUSAJT-UHFFFAOYSA-N
XLogP2.07
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.41
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(2,5-dimethoxyphenyl)acetamide
CID 112999206
N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]acetamide
CID 21383211
N-(2,5-dimethoxyphenyl)-2-[(3-methylphenyl)sulfonylamino]acetamide
CID 112999205
2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
CID 112998742
2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(2,4-dimethoxyphenyl)acetamide
CID 112999269
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 113002239
N-[(2,4-dimethoxyphenyl)methyl]-4-fluoro-3-methylbenzenesulfonamide
CID 110780736
N-(2,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
CID 113001324
N-(2,4-dimethylphenyl)-2-[(4-methoxy-3-methylphenyl)sulfonylamino]acetamide
CID 112996411
2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dimethoxyphenyl)acetamide
CID 126155694
2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(2-methylphenyl)acetamide
CID 112996092
2-(1,3-benzodioxol-5-ylsulfonylamino)-N-(2,4-dimethoxyphenyl)acetamide
CID 112999264

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide (CID 112999196) is N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide is COc1ccc(OC)c(NC(=O)CNS(=O)(=O)c2ccc(F)c(C)c2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The InChIKey is LJZYSKOOHUSAJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O5S/c1-11-8-13(5-6-14(11)18)26(22,23)19-10-17(21)20-15-9-12(24-2)4-7-16(15)25-3/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide has a molecular weight of 382.41 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112999196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).