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

C18H18F3NO2 — CID 112978103

IUPACN-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccccc2C(F)(F)F)cc1C
InChIInChI=1S/C18H18F3NO2/c1-11-8-13(3)16(9-12(11)2)24-10-17(23)22-15-7-5-4-6-14(15)18(19,20)21/h4-9H,10H2,1-3H3,(H,22,23)
InChIKeyZSOVFUQAVSHCJV-UHFFFAOYSA-N
MW337.34 g/mol
LogP4.65
Rot. Bonds4

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

N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide (PubChem CID 112978103) has the molecular formula C18H18F3NO2 and a molecular weight of 337.34 g/mol. Its IUPAC name is N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide
PubChem CID112978103
Molecular FormulaC18H18F3NO2
Molecular Weight337.34 g/mol
Exact Mass337.13
IUPAC NameN-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccccc2C(F)(F)F)cc1C
InChIInChI=1S/C18H18F3NO2/c1-11-8-13(3)16(9-12(11)2)24-10-17(23)22-15-7-5-4-6-14(15)18(19,20)21/h4-9H,10H2,1-3H3,(H,22,23)
InChIKeyZSOVFUQAVSHCJV-UHFFFAOYSA-N
XLogP4.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-(2,5-dimethylphenoxy)acetate
CID 8919136
2-(3,5-dimethoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7713877
2-[4-methyl-2-(1,2,4-triazol-4-yl)phenoxy]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 46366675
N-(2-methoxy-5-methylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 51283496
2-(2,4,6-trichloro-3,5-dimethylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 22778548
N-quinolin-8-yl-2-(2,4,5-trimethylphenoxy)acetamide
CID 112978120
2-(5-bromo-2-chlorophenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 112828407
N-(2-methylphenyl)-2-[4-nitro-2-(trifluoromethyl)phenoxy]acetamide
CID 47073931
methyl 3-bromo-4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]benzoate
CID 36940941
2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1185791
[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-(2-tert-butylphenoxy)acetate
CID 8701075
N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 38435524

Frequently Asked Questions

What is the IUPAC name of N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide?
The IUPAC name of N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide (CID 112978103) is N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide.
What is the SMILES notation for N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide?
The canonical SMILES for N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide is Cc1cc(C)c(OCC(=O)Nc2ccccc2C(F)(F)F)cc1C.
What is the InChIKey of N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide?
The InChIKey is ZSOVFUQAVSHCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3NO2/c1-11-8-13(3)16(9-12(11)2)24-10-17(23)22-15-7-5-4-6-14(15)18(19,20)21/h4-9H,10H2,1-3H3,(H,22,23).
What are the key properties of N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide?
N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide has a molecular weight of 337.34 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide is sourced from PubChem (CID 112978103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).