2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide

C14H9Cl2F2NO2 — CID 7185406

IUPAC2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H9Cl2F2NO2/c15-8-1-3-10(16)13(5-8)21-7-14(20)19-9-2-4-11(17)12(18)6-9/h1-6H,7H2,(H,19,20)
InChIKeySIZWHUVQGAJNGP-UHFFFAOYSA-N
MW332.13 g/mol
LogP4.29
Rot. Bonds4

About 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide

2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide (PubChem CID 7185406) has the molecular formula C14H9Cl2F2NO2 and a molecular weight of 332.13 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide
PubChem CID7185406
Molecular FormulaC14H9Cl2F2NO2
Molecular Weight332.13 g/mol
Exact Mass331.00
IUPAC Name2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H9Cl2F2NO2/c15-8-1-3-10(16)13(5-8)21-7-14(20)19-9-2-4-11(17)12(18)6-9/h1-6H,7H2,(H,19,20)
InChIKeySIZWHUVQGAJNGP-UHFFFAOYSA-N
XLogP4.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.13
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide (CID 7185406) is 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide is O=C(COc1cc(Cl)ccc1Cl)Nc1ccc(F)c(F)c1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide?
The InChIKey is SIZWHUVQGAJNGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2F2NO2/c15-8-1-3-10(16)13(5-8)21-7-14(20)19-9-2-4-11(17)12(18)6-9/h1-6H,7H2,(H,19,20).
What are the key properties of 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide?
2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide has a molecular weight of 332.13 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide is sourced from PubChem (CID 7185406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).