N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide

C16H15F2NO2 — CID 2711364

IUPACN-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C16H15F2NO2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-8-12(17)6-7-13(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyJXNWJRMTHWYSIF-UHFFFAOYSA-N
MW291.30 g/mol
LogP3.60
Rot. Bonds4

About N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide

N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide (PubChem CID 2711364) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide
PubChem CID2711364
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC NameN-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C16H15F2NO2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-8-12(17)6-7-13(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyJXNWJRMTHWYSIF-UHFFFAOYSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide (CID 2711364) is N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide is Cc1cccc(C)c1OCC(=O)Nc1cc(F)ccc1F.
What is the InChIKey of N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
The InChIKey is JXNWJRMTHWYSIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c1-10-4-3-5-11(2)16(10)21-9-15(20)19-14-8-12(17)6-7-13(14)18/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide?
N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide has a molecular weight of 291.30 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-(2,6-dimethylphenoxy)acetamide is sourced from PubChem (CID 2711364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).