2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide

C20H23FN2O3 — CID 42572371

IUPAC2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCCCOc2ccc(F)cc2)cc1
InChIInChI=1S/C20H23FN2O3/c1-15(24)23-18-8-4-16(5-9-18)14-20(25)22-12-2-3-13-26-19-10-6-17(21)7-11-19/h4-11H,2-3,12-14H2,1H3,(H,22,25)(H,23,24)
InChIKeyUIIFMSVVZJXZLT-UHFFFAOYSA-N
MW358.41 g/mol
LogP3.30
Rot. Bonds9

About 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide

2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide (PubChem CID 42572371) has the molecular formula C20H23FN2O3 and a molecular weight of 358.41 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide
PubChem CID42572371
Molecular FormulaC20H23FN2O3
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC Name2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCCCOc2ccc(F)cc2)cc1
InChIInChI=1S/C20H23FN2O3/c1-15(24)23-18-8-4-16(5-9-18)14-20(25)22-12-2-3-13-26-19-10-6-17(21)7-11-19/h4-11H,2-3,12-14H2,1H3,(H,22,25)(H,23,24)
InChIKeyUIIFMSVVZJXZLT-UHFFFAOYSA-N
XLogP3.30
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-bromophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide
CID 42572295
N-[4-[2-(4-fluorophenoxy)ethylcarbamoylamino]phenyl]acetamide
CID 52595243
N-[4-(4-fluorophenoxy)butyl]-3-(4-fluorophenyl)propanamide
CID 134056622
N-(4-ethoxyphenyl)-2-(4-fluorophenyl)acetamide
CID 2289388
2-(4-acetamidophenyl)-N-(6-aminohexyl)acetamide
CID 108792623
2-(4-acetamidophenyl)-N-(3-aminopropyl)acetamide
CID 108792677
N-[4-(4-fluorophenoxy)butyl]-2-(1H-indol-3-yl)acetamide
CID 17405014
N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 108538633
4-amino-N-[4-(4-fluorophenoxy)butyl]butanamide
CID 119274703
1-(4-ethylphenyl)-3-[2-(4-fluorophenoxy)ethyl]urea
CID 112970481
2-(4-fluorophenyl)-N-[4-(4-fluorophenyl)butyl]acetamide
CID 110288734
2-(4-acetamidophenyl)-N-(2-hydroxyethyl)acetamide
CID 11287807

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide (CID 42572371) is 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide is CC(=O)Nc1ccc(CC(=O)NCCCCOc2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide?
The InChIKey is UIIFMSVVZJXZLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3/c1-15(24)23-18-8-4-16(5-9-18)14-20(25)22-12-2-3-13-26-19-10-6-17(21)7-11-19/h4-11H,2-3,12-14H2,1H3,(H,22,25)(H,23,24).
What are the key properties of 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide?
2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide has a molecular weight of 358.41 g/mol, XLogP of 3.30, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide is sourced from PubChem (CID 42572371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).