N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

C17H16F3NO3 — CID 24535021

IUPACN-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(OC)c(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C17H16F3NO3/c1-23-13-7-8-15(24-2)14(10-13)21-16(22)9-11-3-5-12(6-4-11)17(18,19)20/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyRNAOONSJGFBIPO-UHFFFAOYSA-N
MW339.31 g/mol
LogP3.90
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 24535021) has the molecular formula C17H16F3NO3 and a molecular weight of 339.31 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID24535021
Molecular FormulaC17H16F3NO3
Molecular Weight339.31 g/mol
Exact Mass339.11
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(OC)c(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C17H16F3NO3/c1-23-13-7-8-15(24-2)14(10-13)21-16(22)9-11-3-5-12(6-4-11)17(18,19)20/h3-8,10H,9H2,1-2H3,(H,21,22)
InChIKeyRNAOONSJGFBIPO-UHFFFAOYSA-N
XLogP3.90
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.31
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 8800716
N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51272702
N-(2,5-dimethoxyphenyl)-2-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]propanamide
CID 51171449
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide
CID 35495479
[2-(2,4-dimethoxyanilino)-2-oxoethyl]-methyl-[[4-(trifluoromethyl)phenyl]methyl]azanium
CID 9221659
[2-(2,5-dimethoxyanilino)-2-oxoethyl] 2-(4-fluorophenyl)acetate
CID 8613255
N-(2,5-dimethoxyphenyl)-2-(3-hydroxyphenyl)acetamide
CID 61399992
N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)acetamide
CID 1228251
N-(5-acetamido-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 8510112
N-(2,5-dimethoxyphenyl)-3-(trifluoromethyl)benzamide
CID 531811
N-(2,5-dimethoxyphenyl)-4-[(2-phenylacetyl)amino]benzamide
CID 17119475

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 24535021) is N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is COc1ccc(OC)c(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is RNAOONSJGFBIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3NO3/c1-23-13-7-8-15(24-2)14(10-13)21-16(22)9-11-3-5-12(6-4-11)17(18,19)20/h3-8,10H,9H2,1-2H3,(H,21,22).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 339.31 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 24535021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).