2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide

C19H20F3NO2 — CID 1185791

IUPAC2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C19H20F3NO2/c1-18(2,3)13-8-10-14(11-9-13)25-12-17(24)23-16-7-5-4-6-15(16)19(20,21)22/h4-11H,12H2,1-3H3,(H,23,24)
InChIKeyUJAWVCXMUZTCBM-UHFFFAOYSA-N
MW351.37 g/mol
LogP5.02
Rot. Bonds4

About 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide

2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 1185791) has the molecular formula C19H20F3NO2 and a molecular weight of 351.37 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID1185791
Molecular FormulaC19H20F3NO2
Molecular Weight351.37 g/mol
Exact Mass351.14
IUPAC Name2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C19H20F3NO2/c1-18(2,3)13-8-10-14(11-9-13)25-12-17(24)23-16-7-5-4-6-15(16)19(20,21)22/h4-11H,12H2,1-3H3,(H,23,24)
InChIKeyUJAWVCXMUZTCBM-UHFFFAOYSA-N
XLogP5.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.37
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1068388
N-(2-methylphenyl)-4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]benzamide
CID 1188045
N-(2-tert-butylphenyl)-2-(4-fluorophenoxy)acetamide
CID 40597489
1-[2-(4-tert-butylphenoxy)ethyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 112972906
2-(3,5-dimethoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7713877
2-(4-tert-butylphenoxy)-N-[2-oxo-2-[2-(trifluoromethyl)phenyl]ethyl]acetamide
CID 143180145
N-(2-tert-butylphenyl)-2-(4-chlorophenoxy)acetamide
CID 2632006
4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]-N-(2-phenylethyl)benzamide
CID 1182090
N-(2-fluorophenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 7467631
2-(4-tert-butylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 7750374
N-cyclohexyl-4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]benzamide
CID 1182084
2-(4-tert-butylphenoxy)-N-phenylacetamide
CID 963342

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide (CID 1185791) is 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide is CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(F)(F)F)cc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is UJAWVCXMUZTCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3NO2/c1-18(2,3)13-8-10-14(11-9-13)25-12-17(24)23-16-7-5-4-6-15(16)19(20,21)22/h4-11H,12H2,1-3H3,(H,23,24).
What are the key properties of 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide?
2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 351.37 g/mol, XLogP of 5.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 1185791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).