2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide

C18H19FN2O2 — CID 113177666

IUPAC2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(C(C)=O)c2cccc(F)c2)cc1
InChIInChI=1S/C18H19FN2O2/c1-3-14-7-9-16(10-8-14)20-18(23)12-21(13(2)22)17-6-4-5-15(19)11-17/h4-11H,3,12H2,1-2H3,(H,20,23)
InChIKeyDZDIWCREROMJCD-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.38
Rot. Bonds5

About 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide

2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide (PubChem CID 113177666) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide
PubChem CID113177666
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(C(C)=O)c2cccc(F)c2)cc1
InChIInChI=1S/C18H19FN2O2/c1-3-14-7-9-16(10-8-14)20-18(23)12-21(13(2)22)17-6-4-5-15(19)11-17/h4-11H,3,12H2,1-2H3,(H,20,23)
InChIKeyDZDIWCREROMJCD-UHFFFAOYSA-N
XLogP3.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetamidophenyl)-2-(N-acetyl-3-fluoroanilino)acetamide
CID 113177708
2-(N-acetyl-3-fluoroanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113177670
2-(N-acetyl-3,4-difluoroanilino)-N-(4-ethylphenyl)acetamide
CID 113181652
2-(N-acetyl-3-fluoroanilino)-N-(3-methoxyphenyl)acetamide
CID 113177692
2-(N-acetyl-3-fluoroanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 113177755
2-(3-acetamido-N-acetylanilino)-N-(4-acetamidophenyl)acetamide
CID 113175847
2-(N-acetyl-3-fluoroanilino)-N-[(4-fluorophenyl)methyl]acetamide
CID 113177593
2-(N-acetyl-4-ethylanilino)-N-(4-tert-butylphenyl)acetamide
CID 113169317
2-(N-acetyl-4-fluoroanilino)-N-(4-fluorophenyl)acetamide
CID 113171016
2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113169312
N-(4-ethylphenyl)-N'-(3-fluorophenyl)propanediamide
CID 108954059
2-(N-ethyl-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60517438

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide (CID 113177666) is 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)CN(C(C)=O)c2cccc(F)c2)cc1.
What is the InChIKey of 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide?
The InChIKey is DZDIWCREROMJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-3-14-7-9-16(10-8-14)20-18(23)12-21(13(2)22)17-6-4-5-15(19)11-17/h4-11H,3,12H2,1-2H3,(H,20,23).
What are the key properties of 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide?
2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide has a molecular weight of 314.36 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-fluoroanilino)-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 113177666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).