2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

C18H19FN2O3 — CID 4877687

IUPAC2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(=O)NC(C)c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19FN2O3/c1-12(14-3-5-15(19)6-4-14)20-18(23)11-24-17-9-7-16(8-10-17)21-13(2)22/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyDHHKACXQKMHXPO-UHFFFAOYSA-N
MW330.36 g/mol
LogP3.04
Rot. Bonds6

About 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (PubChem CID 4877687) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
PubChem CID4877687
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(=O)NC(C)c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19FN2O3/c1-12(14-3-5-15(19)6-4-14)20-18(23)11-24-17-9-7-16(8-10-17)21-13(2)22/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyDHHKACXQKMHXPO-UHFFFAOYSA-N
XLogP3.04
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 10246762
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N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline
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3-(4-Ethoxyanilino)-1-(4-fluorophenyl)-1-propanol
CID 3427706
2-(2-(tert-Butyl)phenoxy)-N-(4-hydroxyphenyl)acetamide
CID 2975850
N-(4-methylphenyl)-2-[methyl-[2-(2-phenylphenoxy)acetyl]amino]acetamide
CID 4790602
1-(4-{2-[Benzyl(methyl)amino]ethoxy}phenyl)-4-(benzyloxy)pyridin-2(1H)-one
CID 53321223
N-(4-methoxyphenyl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
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N-(2,3-dihydro-1H-inden-5-yl)-2-(2-fluorophenoxy)acetamide
CID 903893
4-(((4-Methoxyphenyl)amino)methyl)quinolin-2-ol
CID 1850508

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (CID 4877687) is 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is CC(=O)Nc1ccc(OCC(=O)NC(C)c2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is DHHKACXQKMHXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-12(14-3-5-15(19)6-4-14)20-18(23)11-24-17-9-7-16(8-10-17)21-13(2)22/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 330.36 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 4877687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).