2-(3,4-difluorophenoxy)-N-phenylpropanamide

C15H13F2NO2 — CID 42982598

IUPAC2-(3,4-difluorophenoxy)-N-phenylpropanamide
SMILESCC(Oc1ccc(F)c(F)c1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H13F2NO2/c1-10(15(19)18-11-5-3-2-4-6-11)20-12-7-8-13(16)14(17)9-12/h2-10H,1H3,(H,18,19)
InChIKeyQSNUVEBKFZEBHO-UHFFFAOYSA-N
MW277.27 g/mol
LogP3.37
Rot. Bonds4

About 2-(3,4-difluorophenoxy)-N-phenylpropanamide

2-(3,4-difluorophenoxy)-N-phenylpropanamide (PubChem CID 42982598) has the molecular formula C15H13F2NO2 and a molecular weight of 277.27 g/mol. Its IUPAC name is 2-(3,4-difluorophenoxy)-N-phenylpropanamide.

Molecular Properties

Compound Name2-(3,4-difluorophenoxy)-N-phenylpropanamide
PubChem CID42982598
Molecular FormulaC15H13F2NO2
Molecular Weight277.27 g/mol
Exact Mass277.09
IUPAC Name2-(3,4-difluorophenoxy)-N-phenylpropanamide
SMILESCC(Oc1ccc(F)c(F)c1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H13F2NO2/c1-10(15(19)18-11-5-3-2-4-6-11)20-12-7-8-13(16)14(17)9-12/h2-10H,1H3,(H,18,19)
InChIKeyQSNUVEBKFZEBHO-UHFFFAOYSA-N
XLogP3.37
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-3-fluorophenoxy)-N-phenylpropanamide
CID 82705817
2-(4-bromo-3-fluorophenoxy)-N-phenylpropanamide
CID 63998044
(2S)-N-(3,4-difluorophenyl)-2-phenoxypropanamide
CID 670052
2-(4-chlorophenoxy)-N-phenylpropanamide
CID 4943865
N-(2-aminophenyl)-2-(3,4-difluorophenoxy)propanamide
CID 43554689
(2S)-N-(3-chloro-4-fluorophenyl)-2-(3,4-difluorophenoxy)propanamide
CID 8578068
N-phenyl-2-(4-phenylphenoxy)propanamide
CID 2969640
2-(4-aminophenoxy)-N-phenylpropanamide
CID 43115954
2-(4-chlorophenoxy)-N-(3-fluorophenyl)propanamide
CID 21173814
2-[2-(3,4-difluorophenoxy)propanoylamino]propanoic acid
CID 119225124
(2R)-2-(3-chloro-4-fluorophenoxy)-N-(3-chlorophenyl)propanamide
CID 7751006
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenoxy)-N-phenylpropanamide?
The IUPAC name of 2-(3,4-difluorophenoxy)-N-phenylpropanamide (CID 42982598) is 2-(3,4-difluorophenoxy)-N-phenylpropanamide.
What is the SMILES notation for 2-(3,4-difluorophenoxy)-N-phenylpropanamide?
The canonical SMILES for 2-(3,4-difluorophenoxy)-N-phenylpropanamide is CC(Oc1ccc(F)c(F)c1)C(=O)Nc1ccccc1.
What is the InChIKey of 2-(3,4-difluorophenoxy)-N-phenylpropanamide?
The InChIKey is QSNUVEBKFZEBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c1-10(15(19)18-11-5-3-2-4-6-11)20-12-7-8-13(16)14(17)9-12/h2-10H,1H3,(H,18,19).
What are the key properties of 2-(3,4-difluorophenoxy)-N-phenylpropanamide?
2-(3,4-difluorophenoxy)-N-phenylpropanamide has a molecular weight of 277.27 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenoxy)-N-phenylpropanamide is sourced from PubChem (CID 42982598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).