N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide

C20H24FNO2 — CID 112778014

IUPACN-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
SMILESCC(Oc1ccc(C(C)C)cc1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C20H24FNO2/c1-14(2)17-6-10-19(11-7-17)24-15(3)20(23)22-13-12-16-4-8-18(21)9-5-16/h4-11,14-15H,12-13H2,1-3H3,(H,22,23)
InChIKeyQXHVWUDLEJCFAU-UHFFFAOYSA-N
MW329.42 g/mol
LogP4.08
Rot. Bonds7

About N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide

N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide (PubChem CID 112778014) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
PubChem CID112778014
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
SMILESCC(Oc1ccc(C(C)C)cc1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C20H24FNO2/c1-14(2)17-6-10-19(11-7-17)24-15(3)20(23)22-13-12-16-4-8-18(21)9-5-16/h4-11,14-15H,12-13H2,1-3H3,(H,22,23)
InChIKeyQXHVWUDLEJCFAU-UHFFFAOYSA-N
XLogP4.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 24511975
N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 108538670
2-(4-fluorophenoxy)-N-[2-(4-propan-2-ylphenyl)ethyl]butanamide
CID 46771830
(2S)-2-(4-bromophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 9391636
4-[1-[2-(4-fluorophenyl)ethylamino]-1-oxopropan-2-yl]oxybenzamide
CID 112778533
2-(4-propan-2-ylphenoxy)-N-[2-[2-(4-propan-2-ylphenoxy)propanoylamino]ethyl]propanamide
CID 4954241
2-(4-fluorophenoxy)-N-[3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 132654154
2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 133164196
2-(4-fluorophenoxy)-N-propylpropanamide
CID 21366860
N-[2-(4-fluorophenyl)ethyl]-2-(3-iodophenoxy)propanamide
CID 112786440
2-(4-fluorophenoxy)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 46654879
(2R)-2-(2-ethylphenoxy)-N-[2-(4-propan-2-ylphenyl)ethyl]propanamide
CID 38000919

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide (CID 112778014) is N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide is CC(Oc1ccc(C(C)C)cc1)C(=O)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide?
The InChIKey is QXHVWUDLEJCFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-14(2)17-6-10-19(11-7-17)24-15(3)20(23)22-13-12-16-4-8-18(21)9-5-16/h4-11,14-15H,12-13H2,1-3H3,(H,22,23).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide?
N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide has a molecular weight of 329.42 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 112778014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).