2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide

C17H18ClFN2O3S — CID 167215417

IUPAC2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide
SMILESCCc1c(C)cc(NC(=O)Cc2ccc(F)cc2Cl)cc1S(N)(=O)=O
InChIInChI=1S/C17H18ClFN2O3S/c1-3-14-10(2)6-13(9-16(14)25(20,23)24)21-17(22)7-11-4-5-12(19)8-15(11)18/h4-6,8-9H,3,7H2,1-2H3,(H,21,22)(H2,20,23,24)
InChIKeyLBXONNMDTYCIKM-UHFFFAOYSA-N
MW384.86 g/mol
LogP3.18
Rot. Bonds5

About 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide

2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide (PubChem CID 167215417) has the molecular formula C17H18ClFN2O3S and a molecular weight of 384.86 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide
PubChem CID167215417
Molecular FormulaC17H18ClFN2O3S
Molecular Weight384.86 g/mol
Exact Mass384.07
IUPAC Name2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide
SMILESCCc1c(C)cc(NC(=O)Cc2ccc(F)cc2Cl)cc1S(N)(=O)=O
InChIInChI=1S/C17H18ClFN2O3S/c1-3-14-10(2)6-13(9-16(14)25(20,23)24)21-17(22)7-11-4-5-12(19)8-15(11)18/h4-6,8-9H,3,7H2,1-2H3,(H,21,22)(H2,20,23,24)
InChIKeyLBXONNMDTYCIKM-UHFFFAOYSA-N
XLogP3.18
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.86
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
CID 134706391
N-[4-bromo-3-[(dimethylamino)methylsulfamoyl]phenyl]-2-(2-chloro-4-fluorophenyl)acetamide
CID 166493197
2-(2-chloro-5-fluorophenyl)-N-[4-[(4-fluorophenoxy)methyl]-3-sulfamoylphenyl]acetamide
CID 164596527
2-(2-chloro-4-fluorophenyl)-N-(6-chloropyridazin-4-yl)acetamide
CID 162428281
4-[[2-(2-chlorophenyl)acetyl]amino]-N-(4-fluorophenyl)-2-sulfamoylbenzamide
CID 134604003
2-(2-chloro-4-fluorophenyl)-N-[4-[(5-fluoro-2-pyridinyl)oxymethyl]-3-methylphenyl]acetamide
CID 167200495
2-(2-chlorophenyl)-N-[4-(hydroxymethyl)-3-sulfamoylphenyl]acetamide
CID 167200814
N-(4-bromo-3-methylphenyl)-2-(2,4-dichlorophenyl)acetamide
CID 7959233
2-(2,4-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
CID 42965042
N-[(2-chloro-4-fluorophenyl)methyl]-3,4-dimethylaniline
CID 28555155
2-(2-chloro-4-fluorophenyl)-N-(cyanomethyl)acetamide
CID 126773085
4-bromo-N-[(2-chloro-4-fluorophenyl)methyl]-3,5-dimethylaniline
CID 107573481

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide (CID 167215417) is 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide is CCc1c(C)cc(NC(=O)Cc2ccc(F)cc2Cl)cc1S(N)(=O)=O.
What is the InChIKey of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide?
The InChIKey is LBXONNMDTYCIKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClFN2O3S/c1-3-14-10(2)6-13(9-16(14)25(20,23)24)21-17(22)7-11-4-5-12(19)8-15(11)18/h4-6,8-9H,3,7H2,1-2H3,(H,21,22)(H2,20,23,24).
What are the key properties of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide?
2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide has a molecular weight of 384.86 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide is sourced from PubChem (CID 167215417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).