N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

C17H16F3NO — CID 23579193

IUPACN-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C17H16F3NO/c1-2-12-4-3-5-15(10-12)21-16(22)11-13-6-8-14(9-7-13)17(18,19)20/h3-10H,2,11H2,1H3,(H,21,22)
InChIKeyWERIWUTURWDTES-UHFFFAOYSA-N
MW307.32 g/mol
LogP4.45
Rot. Bonds4

About N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 23579193) has the molecular formula C17H16F3NO and a molecular weight of 307.32 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID23579193
Molecular FormulaC17H16F3NO
Molecular Weight307.32 g/mol
Exact Mass307.12
IUPAC NameN-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCCc1cccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C17H16F3NO/c1-2-12-4-3-5-15(10-12)21-16(22)11-13-6-8-14(9-7-13)17(18,19)20/h3-10H,2,11H2,1H3,(H,21,22)
InChIKeyWERIWUTURWDTES-UHFFFAOYSA-N
XLogP4.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.32
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-ethylphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 123188980
2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide
CID 63589585
N-(3-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55462625
N-(3-ethylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 34280640
N-methyl-2-[4-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetamide
CID 38402676
N-(4-acetamidophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51271866
2-(4-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2666418
2-chloro-N-(3-ethylphenyl)acetamide
CID 2384588
N-(3-pyrimidin-2-yloxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 39261092
N-cyclopropyl-3-[[2-[4-(trifluoromethyl)phenyl]acetyl]amino]benzamide
CID 24535194
2-(3-aminophenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 28712241
2-(2-aminophenyl)-N-(3-ethylphenyl)acetamide
CID 16785552

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 23579193) is N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is CCc1cccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is WERIWUTURWDTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3NO/c1-2-12-4-3-5-15(10-12)21-16(22)11-13-6-8-14(9-7-13)17(18,19)20/h3-10H,2,11H2,1H3,(H,21,22).
What are the key properties of N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 307.32 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 23579193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).