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

C17H16F4N2O — CID 109000567

IUPACN-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide
SMILESO=C(CNc1ccccc1C(F)(F)F)NCCc1ccc(F)cc1
InChIInChI=1S/C17H16F4N2O/c18-13-7-5-12(6-8-13)9-10-22-16(24)11-23-15-4-2-1-3-14(15)17(19,20)21/h1-8,23H,9-11H2,(H,22,24)
InChIKeyGDLVVHWCXCRDSH-UHFFFAOYSA-N
MW340.32 g/mol
LogP3.62
Rot. Bonds6

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

N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide (PubChem CID 109000567) has the molecular formula C17H16F4N2O and a molecular weight of 340.32 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide
PubChem CID109000567
Molecular FormulaC17H16F4N2O
Molecular Weight340.32 g/mol
Exact Mass340.12
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide
SMILESO=C(CNc1ccccc1C(F)(F)F)NCCc1ccc(F)cc1
InChIInChI=1S/C17H16F4N2O/c18-13-7-5-12(6-8-13)9-10-22-16(24)11-23-15-4-2-1-3-14(15)17(19,20)21/h1-8,23H,9-11H2,(H,22,24)
InChIKeyGDLVVHWCXCRDSH-UHFFFAOYSA-N
XLogP3.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.32
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide
CID 109001307
2-(2-bromoanilino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 33161527
N-[2-(2-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide
CID 109000338
N-[2-(4-fluorophenyl)ethyl]-2-(2-methylsulfanylanilino)acetamide
CID 35811388
2-[2-[[acetyl(ethyl)amino]methyl]anilino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 36856140
N-(2-tert-butylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
CID 109000452
2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
CID 112993239
2-[2-fluoro-5-(trifluoromethyl)anilino]-N-(2-phenylethyl)acetamide
CID 86886800
2-[2-(trifluoromethyl)anilino]acetic acid
CID 21238931
N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide
CID 109009674
2-(4-chloro-2-methylanilino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 37476152
2-(4-acetamidoanilino)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 109000569

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide (CID 109000567) is N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide is O=C(CNc1ccccc1C(F)(F)F)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide?
The InChIKey is GDLVVHWCXCRDSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F4N2O/c18-13-7-5-12(6-8-13)9-10-22-16(24)11-23-15-4-2-1-3-14(15)17(19,20)21/h1-8,23H,9-11H2,(H,22,24).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide?
N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide has a molecular weight of 340.32 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-[2-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 109000567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).