2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide

C18H20FNO3 — CID 110902168

IUPAC2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
SMILESCC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C18H20FNO3/c1-18(2,23-16-9-5-14(19)6-10-16)17(22)20-15-7-3-13(4-8-15)11-12-21/h3-10,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyYTOXJHQLMDKSEE-UHFFFAOYSA-N
MW317.36 g/mol
LogP3.16
Rot. Bonds6

About 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide

2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide (PubChem CID 110902168) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
PubChem CID110902168
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
SMILESCC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C18H20FNO3/c1-18(2,23-16-9-5-14(19)6-10-16)17(22)20-15-7-3-13(4-8-15)11-12-21/h3-10,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyYTOXJHQLMDKSEE-UHFFFAOYSA-N
XLogP3.16
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-hydroxyethyl)phenyl]-2-methoxy-2-methylpropanamide
CID 103771888
N-[4-(4-ethoxyphenyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
CID 164531783
2-(4-fluorophenoxy)-N-[4-[4-(1-methoxyethyl)phenyl]phenyl]-2-methylpropanamide
CID 164531778
dimethyl 5-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]benzene-1,3-dicarboxylate
CID 30855027
2-(4-chlorophenoxy)-N-(4-ethylphenyl)-2-methylpropanamide
CID 887329
2-(4-fluorophenoxy)-2-methylpropanehydrazide
CID 43236623
2-(4-chlorophenoxy)-N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]-2-methylpropanamide
CID 100518354
2-(4-fluorophenoxy)-N-(4-hydroxy-2,2-dimethylbutyl)-2-methylpropanamide
CID 103772311
tert-butyl 2-[4-(2-hydroxyethyl)phenoxy]-2-methylpropanoate
CID 24754221
N-(2,4-difluorophenyl)-2-(4-fluorophenoxy)-2-methylpropanamide
CID 30854578
2-(4-fluorophenoxy)-N-(2-hydroxyphenyl)-2-methylpropanamide
CID 86978390
2-(4-fluorophenoxy)-N-(1-hydroxy-3-methylpentan-3-yl)-2-methylpropanamide
CID 106167676

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide (CID 110902168) is 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide is CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc(CCO)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide?
The InChIKey is YTOXJHQLMDKSEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-18(2,23-16-9-5-14(19)6-10-16)17(22)20-15-7-3-13(4-8-15)11-12-21/h3-10,21H,11-12H2,1-2H3,(H,20,22).
What are the key properties of 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide?
2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide has a molecular weight of 317.36 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide is sourced from PubChem (CID 110902168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).