N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide

C17H16F3NO — CID 58853713

IUPACN-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NCCc1ccccc1
InChIInChI=1S/C17H16F3NO/c18-17(19,20)15-8-6-14(7-9-15)12-16(22)21-11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,21,22)
InChIKeyKAFJRCJOCTVXRC-UHFFFAOYSA-N
MW307.32 g/mol
LogP3.61
Rot. Bonds5

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

N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 58853713) has the molecular formula C17H16F3NO and a molecular weight of 307.32 g/mol. Its IUPAC name is N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID58853713
Molecular FormulaC17H16F3NO
Molecular Weight307.32 g/mol
Exact Mass307.12
IUPAC NameN-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NCCc1ccccc1
InChIInChI=1S/C17H16F3NO/c18-17(19,20)15-8-6-14(7-9-15)12-16(22)21-11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,21,22)
InChIKeyKAFJRCJOCTVXRC-UHFFFAOYSA-N
XLogP3.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.32
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chlorophenyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 26594302
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylacetamide
CID 11857553
N-[2-[[2-[(2-phenylacetyl)amino]acetyl]amino]ethyl]-4-(trifluoromethyl)benzamide
CID 55546139
2-oxo-2-phenyl-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 154260012
N-[2-(benzylsulfamoyl)ethyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55726450
2-(2-phenyl-1,3-oxazol-4-yl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 34810970
4-phenyl-1-[4-(trifluoromethyl)phenyl]butan-2-one
CID 62115398
2-methyl-N-[2-oxo-2-[2-[4-(trifluoromethyl)phenyl]ethylamino]ethyl]benzamide
CID 51162268
2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
CID 112993239
2-iodo-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 26594284
N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]-2-phenylacetamide
CID 26686373
4-methyl-N-[2-[4-(trifluoromethyl)phenyl]ethyl]pentanamide
CID 78768780

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 58853713) is N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccc(C(F)(F)F)cc1)NCCc1ccccc1.
What is the InChIKey of N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is KAFJRCJOCTVXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3NO/c18-17(19,20)15-8-6-14(7-9-15)12-16(22)21-11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,21,22).
What are the key properties of N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 307.32 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 58853713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).