2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide

C19H15F3N2O3S — CID 55878446

IUPAC2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide
SMILESCN(c1ccc2ccccc2c1)S(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1
InChIInChI=1S/C19H15F3N2O3S/c1-24(16-9-6-13-4-2-3-5-14(13)12-16)28(26,27)17-10-7-15(8-11-17)23-18(25)19(20,21)22/h2-12H,1H3,(H,23,25)
InChIKeyJGJPGNHRZPJUST-UHFFFAOYSA-N
MW408.40 g/mol
LogP4.17
Rot. Bonds4

About 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide

2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide (PubChem CID 55878446) has the molecular formula C19H15F3N2O3S and a molecular weight of 408.40 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide
PubChem CID55878446
Molecular FormulaC19H15F3N2O3S
Molecular Weight408.40 g/mol
Exact Mass408.08
IUPAC Name2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide
SMILESCN(c1ccc2ccccc2c1)S(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1
InChIInChI=1S/C19H15F3N2O3S/c1-24(16-9-6-13-4-2-3-5-14(13)12-16)28(26,27)17-10-7-15(8-11-17)23-18(25)19(20,21)22/h2-12H,1H3,(H,23,25)
InChIKeyJGJPGNHRZPJUST-UHFFFAOYSA-N
XLogP4.17
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.40
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(benzenesulfonyl)phenyl]-2,2,2-trifluoroacetamide
CID 131852564
N-[4-[benzyl-[2-(dimethylamino)ethyl]sulfamoyl]phenyl]-2,2,2-trifluoroacetamide
CID 55903709
N-[4-(dimethylamino)phenyl]-2-naphthalen-2-ylsulfonylacetamide
CID 3938895
2,2,2-trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]acetamide
CID 5013683
1-acetamido-4-[(4-fluorosulfonyloxyphenyl)-methylsulfamoyl]benzene
CID 154880193
[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-[4-[methyl(naphthalen-2-ylsulfonyl)amino]phenoxy]acetate
CID 25039582
5-[benzenesulfonyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide
CID 50810605
3,4-diethoxy-N-methyl-N-naphthalen-2-ylbenzenesulfonamide
CID 9056065
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-naphthalen-2-ylacetamide
CID 9403525
4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 1265832
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2,2,2-trifluoroacetamide
CID 62735221
ethyl 3-[4-[methyl(phenyl)sulfamoyl]anilino]-3-oxopropanoate
CID 17097503

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide (CID 55878446) is 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide is CN(c1ccc2ccccc2c1)S(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1.
What is the InChIKey of 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is JGJPGNHRZPJUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O3S/c1-24(16-9-6-13-4-2-3-5-14(13)12-16)28(26,27)17-10-7-15(8-11-17)23-18(25)19(20,21)22/h2-12H,1H3,(H,23,25).
What are the key properties of 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide?
2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 408.40 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[4-[methyl(naphthalen-2-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 55878446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).