2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide

C18H20FNO3 — CID 111566092

IUPAC2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide
SMILESCCc1ccc(OCC(=O)NCC(O)c2ccccc2F)cc1
InChIInChI=1S/C18H20FNO3/c1-2-13-7-9-14(10-8-13)23-12-18(22)20-11-17(21)15-5-3-4-6-16(15)19/h3-10,17,21H,2,11-12H2,1H3,(H,20,22)
InChIKeyQWPRDNLJLICNNJ-UHFFFAOYSA-N
MW317.36 g/mol
LogP2.62
Rot. Bonds7

About 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide

2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide (PubChem CID 111566092) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide
PubChem CID111566092
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide
SMILESCCc1ccc(OCC(=O)NCC(O)c2ccccc2F)cc1
InChIInChI=1S/C18H20FNO3/c1-2-13-7-9-14(10-8-13)23-12-18(22)20-11-17(21)15-5-3-4-6-16(15)19/h3-10,17,21H,2,11-12H2,1H3,(H,20,22)
InChIKeyQWPRDNLJLICNNJ-UHFFFAOYSA-N
XLogP2.62
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-dimethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide
CID 111566012
N-(3,3-difluoro-2-hydroxypropyl)-2-(4-ethylphenoxy)acetamide
CID 103770190
1-(4-ethylphenyl)-3-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]urea
CID 51944583
2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
CID 1120997
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-3-methylbutanamide
CID 71982886
N-[2-(diethylamino)-2-phenylethyl]-2-(4-ethylphenoxy)acetamide
CID 45155375
N-(3-amino-2-methylpropyl)-2-(4-ethylphenoxy)acetamide
CID 119996402
N-[(2S)-2-hydroxy-2-[2-(trifluoromethyl)phenyl]ethyl]-2-phenoxyacetamide
CID 94810445
N-[(2S)-2-(2-chlorophenyl)-2-piperidin-1-ylethyl]-2-(4-ethylphenoxy)acetamide
CID 35043337
2-[4-(4-chlorobenzoyl)phenoxy]-N-[2-(2,4-difluorophenyl)-2-hydroxyethyl]acetamide
CID 60508635
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-4-methoxybenzamide
CID 111566266
3-[[[2-(4-ethylphenoxy)acetyl]amino]methyl]pentanoic acid
CID 81065749

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide (CID 111566092) is 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide is CCc1ccc(OCC(=O)NCC(O)c2ccccc2F)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide?
The InChIKey is QWPRDNLJLICNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-2-13-7-9-14(10-8-13)23-12-18(22)20-11-17(21)15-5-3-4-6-16(15)19/h3-10,17,21H,2,11-12H2,1H3,(H,20,22).
What are the key properties of 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide?
2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide has a molecular weight of 317.36 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide is sourced from PubChem (CID 111566092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).