2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide

C15H11F2NO3 — CID 115955813

IUPAC2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide
SMILESO=Cc1cccc(F)c1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C15H11F2NO3/c16-11-5-1-2-7-13(11)18-14(20)9-21-15-10(8-19)4-3-6-12(15)17/h1-8H,9H2,(H,18,20)
InChIKeyAPEUTWXNTBMNON-UHFFFAOYSA-N
MW291.25 g/mol
LogP2.79
Rot. Bonds5

About 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide

2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide (PubChem CID 115955813) has the molecular formula C15H11F2NO3 and a molecular weight of 291.25 g/mol. Its IUPAC name is 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide
PubChem CID115955813
Molecular FormulaC15H11F2NO3
Molecular Weight291.25 g/mol
Exact Mass291.07
IUPAC Name2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide
SMILESO=Cc1cccc(F)c1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C15H11F2NO3/c16-11-5-1-2-7-13(11)18-14(20)9-21-15-10(8-19)4-3-6-12(15)17/h1-8H,9H2,(H,18,20)
InChIKeyAPEUTWXNTBMNON-UHFFFAOYSA-N
XLogP2.79
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.25
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide
CID 115955695
N-(2-fluorophenyl)-2-(2-formyl-6-methylphenoxy)acetamide
CID 115955575
2-(2-formyl-6-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 115955536
N-(2-aminophenyl)-2-(2,6-difluorophenoxy)acetamide
CID 81268833
N-(2-fluorophenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2558525
N-cyclohexyl-2-(2-fluoro-6-formylphenoxy)acetamide
CID 115955712
N-(4-bromo-2-fluorophenyl)-2-(2-formylphenoxy)acetamide
CID 17202089
N-(2-fluorophenyl)-2-(3-methylphenoxy)acetamide
CID 723312
2-(2,3-dimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 720662
4-[2-(2-fluoroanilino)-2-oxoethoxy]-3,5-dimethoxybenzoic acid
CID 99989728
N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929098
2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
CID 65102015

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide (CID 115955813) is 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide is O=Cc1cccc(F)c1OCC(=O)Nc1ccccc1F.
What is the InChIKey of 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide?
The InChIKey is APEUTWXNTBMNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2NO3/c16-11-5-1-2-7-13(11)18-14(20)9-21-15-10(8-19)4-3-6-12(15)17/h1-8H,9H2,(H,18,20).
What are the key properties of 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide?
2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide has a molecular weight of 291.25 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 115955813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).