N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide

C17H14ClF3N2O3 — CID 55915573

IUPACN-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESCC(=O)Nc1ccc(Cl)c(NC(=O)COc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C17H14ClF3N2O3/c1-10(24)22-12-5-6-14(18)15(8-12)23-16(25)9-26-13-4-2-3-11(7-13)17(19,20)21/h2-8H,9H2,1H3,(H,22,24)(H,23,25)
InChIKeyVVXJOPAGSRTSRI-UHFFFAOYSA-N
MW386.76 g/mol
LogP4.33
Rot. Bonds5

About N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide

N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide (PubChem CID 55915573) has the molecular formula C17H14ClF3N2O3 and a molecular weight of 386.76 g/mol. Its IUPAC name is N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
PubChem CID55915573
Molecular FormulaC17H14ClF3N2O3
Molecular Weight386.76 g/mol
Exact Mass386.06
IUPAC NameN-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESCC(=O)Nc1ccc(Cl)c(NC(=O)COc2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C17H14ClF3N2O3/c1-10(24)22-12-5-6-14(18)15(8-12)23-16(25)9-26-13-4-2-3-11(7-13)17(19,20)21/h2-8H,9H2,1H3,(H,22,24)(H,23,25)
InChIKeyVVXJOPAGSRTSRI-UHFFFAOYSA-N
XLogP4.33
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.76
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-acetamido-2-methoxyphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 16564447
N-(3-chloro-4-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100757579
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 747189
N-(3-chloro-4-fluorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100757682
2-[3-(trifluoromethyl)phenoxy]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100757803
N-(3-ethylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 34280640
N-methyl-2-[4-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]phenyl]acetamide
CID 35364913
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 1184428
N-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 7980515
2-(4-acetamidophenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 7203488
3-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 18084407
2-(3-acetamidophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 964555

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide (CID 55915573) is N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide is CC(=O)Nc1ccc(Cl)c(NC(=O)COc2cccc(C(F)(F)F)c2)c1.
What is the InChIKey of N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is VVXJOPAGSRTSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClF3N2O3/c1-10(24)22-12-5-6-14(18)15(8-12)23-16(25)9-26-13-4-2-3-11(7-13)17(19,20)21/h2-8H,9H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 386.76 g/mol, XLogP of 4.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 55915573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).