2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide

C14H11BrFNO2 — CID 797441

IUPAC2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide
SMILESO=C(COc1cccc(Br)c1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11BrFNO2/c15-10-2-1-3-13(8-10)19-9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18)
InChIKeyRZKPCPRMSPKOND-UHFFFAOYSA-N
MW324.15 g/mol
LogP3.61
Rot. Bonds4

About 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide

2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide (PubChem CID 797441) has the molecular formula C14H11BrFNO2 and a molecular weight of 324.15 g/mol. Its IUPAC name is 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide
PubChem CID797441
Molecular FormulaC14H11BrFNO2
Molecular Weight324.15 g/mol
Exact Mass323.00
IUPAC Name2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide
SMILESO=C(COc1cccc(Br)c1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11BrFNO2/c15-10-2-1-3-13(8-10)19-9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18)
InChIKeyRZKPCPRMSPKOND-UHFFFAOYSA-N
XLogP3.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.15
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide (CID 797441) is 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide is O=C(COc1cccc(Br)c1)Nc1ccc(F)cc1.
What is the InChIKey of 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide?
The InChIKey is RZKPCPRMSPKOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c15-10-2-1-3-13(8-10)19-9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18).
What are the key properties of 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide?
2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide has a molecular weight of 324.15 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenoxy)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 797441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).