2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide

C14H9ClF3NO2 — CID 30273064

IUPAC2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
SMILESO=C(COc1ccc(F)cc1Cl)Nc1cc(F)ccc1F
InChIInChI=1S/C14H9ClF3NO2/c15-10-5-8(16)2-4-13(10)21-7-14(20)19-12-6-9(17)1-3-11(12)18/h1-6H,7H2,(H,19,20)
InChIKeyWMYRDOPOLSXQJZ-UHFFFAOYSA-N
MW315.68 g/mol
LogP3.77
Rot. Bonds4

About 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide

2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide (PubChem CID 30273064) has the molecular formula C14H9ClF3NO2 and a molecular weight of 315.68 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
PubChem CID30273064
Molecular FormulaC14H9ClF3NO2
Molecular Weight315.68 g/mol
Exact Mass315.03
IUPAC Name2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
SMILESO=C(COc1ccc(F)cc1Cl)Nc1cc(F)ccc1F
InChIInChI=1S/C14H9ClF3NO2/c15-10-5-8(16)2-4-13(10)21-7-14(20)19-12-6-9(17)1-3-11(12)18/h1-6H,7H2,(H,19,20)
InChIKeyWMYRDOPOLSXQJZ-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.68
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide (CID 30273064) is 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide is O=C(COc1ccc(F)cc1Cl)Nc1cc(F)ccc1F.
What is the InChIKey of 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide?
The InChIKey is WMYRDOPOLSXQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF3NO2/c15-10-5-8(16)2-4-13(10)21-7-14(20)19-12-6-9(17)1-3-11(12)18/h1-6H,7H2,(H,19,20).
What are the key properties of 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide?
2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide has a molecular weight of 315.68 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide is sourced from PubChem (CID 30273064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).