N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide

C20H23NO4 — CID 7732574

IUPACN-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccc(C(C)=O)cc2)cc1
InChIInChI=1S/C20H23NO4/c1-3-24-18-10-12-19(13-11-18)25-14-4-5-20(23)21-17-8-6-16(7-9-17)15(2)22/h6-13H,3-5,14H2,1-2H3,(H,21,23)
InChIKeyLVWDQFGXXABSCA-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.09
Rot. Bonds9

About N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide

N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide (PubChem CID 7732574) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide
PubChem CID7732574
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC NameN-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide
SMILESCCOc1ccc(OCCCC(=O)Nc2ccc(C(C)=O)cc2)cc1
InChIInChI=1S/C20H23NO4/c1-3-24-18-10-12-19(13-11-18)25-14-4-5-20(23)21-17-8-6-16(7-9-17)15(2)22/h6-13H,3-5,14H2,1-2H3,(H,21,23)
InChIKeyLVWDQFGXXABSCA-UHFFFAOYSA-N
XLogP4.09
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[4-(4-acetylphenoxy)butanoylamino]-N-(4-ethoxyphenyl)benzamide
CID 4270360
methyl 4-[4-(4-acetylphenoxy)butanoylamino]benzoate
CID 7741287
butyl 4-[4-(4-acetylphenoxy)butanoylamino]benzoate
CID 7926976
4-(4-acetylphenoxy)-N-(4-methylsulfanylphenyl)butanamide
CID 27364869
3-(4-acetylanilino)-N-(4-ethoxyphenyl)propanamide
CID 109039871
N,N'-bis(4-ethoxyphenyl)nonanediamide
CID 4507995
[2-(4-acetylanilino)-2-oxoethyl] 3-(4-ethoxyphenoxy)propanoate
CID 16535326
N-(4-acetylphenyl)-N'-(4-ethoxyphenyl)oxamide
CID 108514413
4-(4-ethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 19173503
4-[2-[6-[2-[4-(4-ethoxyanilino)-4-oxobutanoyl]hydrazinyl]-6-oxohexanoyl]hydrazinyl]-N-(4-ethoxyphenyl)-4-oxobutanamide
CID 5119959
4-[2-[5-[2-[4-(4-ethoxyanilino)-4-oxobutanoyl]hydrazinyl]-5-oxopentanoyl]hydrazinyl]-N-(4-ethoxyphenyl)-4-oxobutanamide
CID 5119958
[2-[4-(butanoylamino)phenyl]-2-oxoethyl] 4-(4-acetylphenoxy)butanoate
CID 7431944

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide?
The IUPAC name of N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide (CID 7732574) is N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide?
The canonical SMILES for N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide is CCOc1ccc(OCCCC(=O)Nc2ccc(C(C)=O)cc2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide?
The InChIKey is LVWDQFGXXABSCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-3-24-18-10-12-19(13-11-18)25-14-4-5-20(23)21-17-8-6-16(7-9-17)15(2)22/h6-13H,3-5,14H2,1-2H3,(H,21,23).
What are the key properties of N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide?
N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide has a molecular weight of 341.41 g/mol, XLogP of 4.09, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-(4-ethoxyphenoxy)butanamide is sourced from PubChem (CID 7732574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).