2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide

C15H11ClF4N2O — CID 26438653

IUPAC2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc(F)cc1
InChIInChI=1S/C15H11ClF4N2O/c16-13-6-5-11(7-12(13)15(18,19)20)21-8-14(23)22-10-3-1-9(17)2-4-10/h1-7,21H,8H2,(H,22,23)
InChIKeyVHHYZTOIUDRDER-UHFFFAOYSA-N
MW346.71 g/mol
LogP4.55
Rot. Bonds4

About 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide

2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide (PubChem CID 26438653) has the molecular formula C15H11ClF4N2O and a molecular weight of 346.71 g/mol. Its IUPAC name is 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide
PubChem CID26438653
Molecular FormulaC15H11ClF4N2O
Molecular Weight346.71 g/mol
Exact Mass346.05
IUPAC Name2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc(F)cc1
InChIInChI=1S/C15H11ClF4N2O/c16-13-6-5-11(7-12(13)15(18,19)20)21-8-14(23)22-10-3-1-9(17)2-4-10/h1-7,21H,8H2,(H,22,23)
InChIKeyVHHYZTOIUDRDER-UHFFFAOYSA-N
XLogP4.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.71
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-chloro-3-(trifluoromethyl)anilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 109009821
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-ethylphenyl)acetamide
CID 109007711
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(3,5-dimethylanilino)acetamide
CID 109007487
N-(3-chloro-4-methoxyphenyl)-2-[4-chloro-3-(trifluoromethyl)anilino]acetamide
CID 109008853
2-(3-chloro-4-methoxyanilino)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 109008828
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4-fluorophenyl)methylcarbamoylamino]acetamide
CID 26022207
2-(2-chloro-5-methylanilino)-N-(4-fluorophenyl)acetamide
CID 103768049
N-[4-chloro-3-(trifluoromethyl)phenyl]-3,3-dimethylbutanamide
CID 803107
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(2-cyanophenyl)acetamide
CID 2532266
2-(4-chloro-3-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 47313465
N-[(4-chlorophenyl)methyl]-2-[4-chloro-3-(trifluoromethyl)anilino]acetamide
CID 108998273
methyl 2-[[2-[4-chloro-3-(trifluoromethyl)anilino]acetyl]amino]benzoate
CID 9101546

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide (CID 26438653) is 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide is O=C(CNc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc(F)cc1.
What is the InChIKey of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide?
The InChIKey is VHHYZTOIUDRDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF4N2O/c16-13-6-5-11(7-12(13)15(18,19)20)21-8-14(23)22-10-3-1-9(17)2-4-10/h1-7,21H,8H2,(H,22,23).
What are the key properties of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide?
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide has a molecular weight of 346.71 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 26438653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).