N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide

C18H20FNO2 — CID 53286461

IUPACN-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccccc2F)cc1
InChIInChI=1S/C18H20FNO2/c1-3-13-9-11-14(12-10-13)20-18(21)16(4-2)22-17-8-6-5-7-15(17)19/h5-12,16H,3-4H2,1-2H3,(H,20,21)
InChIKeyQGRHXHNOZSLZPH-UHFFFAOYSA-N
MW301.36 g/mol
LogP4.18
Rot. Bonds6

About N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide

N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide (PubChem CID 53286461) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide
PubChem CID53286461
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC NameN-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccccc2F)cc1
InChIInChI=1S/C18H20FNO2/c1-3-13-9-11-14(12-10-13)20-18(21)16(4-2)22-17-8-6-5-7-15(17)19/h5-12,16H,3-4H2,1-2H3,(H,20,21)
InChIKeyQGRHXHNOZSLZPH-UHFFFAOYSA-N
XLogP4.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(4-acetamidophenyl)-2-(2-fluorophenoxy)butanamide
CID 9180312
2-[[2-[4-[2-(2-fluorophenoxy)butanoylamino]phenyl]acetyl]amino]acetic acid
CID 119224438
(2S)-N-(4-ethylphenyl)-2-naphthalen-1-yloxybutanamide
CID 92683938
N-(3,4-dimethoxyphenyl)-2-(2-fluorophenoxy)butanamide
CID 44782476
(2R)-N-(3,4-dimethoxyphenyl)-2-(2-fluorophenoxy)butanamide
CID 40742385
(2R)-2-(2,3-dimethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 92679319
N-[4-(diethylsulfamoyl)phenyl]-2-(2-fluorophenoxy)butanamide
CID 78843000
N-[2-(4-ethylphenoxy)ethyl]-2-(2-fluorophenoxy)butanamide
CID 133211115
(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide
CID 40746709
2-(2-fluorophenoxy)-N-propan-2-ylbutanamide
CID 53286261
(2S)-2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]butanamide
CID 99817878
(2S)-2-(2-fluorophenoxy)-N-(2-propan-2-ylphenyl)butanamide
CID 9181809

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide?
The IUPAC name of N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide (CID 53286461) is N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide is CCc1ccc(NC(=O)C(CC)Oc2ccccc2F)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide?
The InChIKey is QGRHXHNOZSLZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-3-13-9-11-14(12-10-13)20-18(21)16(4-2)22-17-8-6-5-7-15(17)19/h5-12,16H,3-4H2,1-2H3,(H,20,21).
What are the key properties of N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide?
N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide has a molecular weight of 301.36 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide is sourced from PubChem (CID 53286461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).