2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide

C18H13Cl2FN2O3 — CID 16866911

IUPAC2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCc1cc(-c2ccc(F)cc2)on1
InChIInChI=1S/C18H13Cl2FN2O3/c19-12-3-6-16(15(20)7-12)25-10-18(24)22-9-14-8-17(26-23-14)11-1-4-13(21)5-2-11/h1-8H,9-10H2,(H,22,24)
InChIKeyFHYVNRQEXUPXDL-UHFFFAOYSA-N
MW395.22 g/mol
LogP4.48
Rot. Bonds6

About 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide

2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide (PubChem CID 16866911) has the molecular formula C18H13Cl2FN2O3 and a molecular weight of 395.22 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
PubChem CID16866911
Molecular FormulaC18H13Cl2FN2O3
Molecular Weight395.22 g/mol
Exact Mass394.03
IUPAC Name2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCc1cc(-c2ccc(F)cc2)on1
InChIInChI=1S/C18H13Cl2FN2O3/c19-12-3-6-16(15(20)7-12)25-10-18(24)22-9-14-8-17(26-23-14)11-1-4-13(21)5-2-11/h1-8H,9-10H2,(H,22,24)
InChIKeyFHYVNRQEXUPXDL-UHFFFAOYSA-N
XLogP4.48
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.22
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]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-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide (CID 16866911) is 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide is O=C(COc1ccc(Cl)cc1Cl)NCc1cc(-c2ccc(F)cc2)on1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide?
The InChIKey is FHYVNRQEXUPXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2FN2O3/c19-12-3-6-16(15(20)7-12)25-10-18(24)22-9-14-8-17(26-23-14)11-1-4-13(21)5-2-11/h1-8H,9-10H2,(H,22,24).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide?
2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide has a molecular weight of 395.22 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide is sourced from PubChem (CID 16866911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).