N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide

C15H12F3NO2 — CID 51158552

IUPACN-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide
SMILESO=C(CCOc1ccccc1F)Nc1ccc(F)cc1F
InChIInChI=1S/C15H12F3NO2/c16-10-5-6-13(12(18)9-10)19-15(20)7-8-21-14-4-2-1-3-11(14)17/h1-6,9H,7-8H2,(H,19,20)
InChIKeyJXFKMCFLNIVMHS-UHFFFAOYSA-N
MW295.26 g/mol
LogP3.51
Rot. Bonds5

About N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide

N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide (PubChem CID 51158552) has the molecular formula C15H12F3NO2 and a molecular weight of 295.26 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide
PubChem CID51158552
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC NameN-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide
SMILESO=C(CCOc1ccccc1F)Nc1ccc(F)cc1F
InChIInChI=1S/C15H12F3NO2/c16-10-5-6-13(12(18)9-10)19-15(20)7-8-21-14-4-2-1-3-11(14)17/h1-6,9H,7-8H2,(H,19,20)
InChIKeyJXFKMCFLNIVMHS-UHFFFAOYSA-N
XLogP3.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-fluorophenoxy)-N-(4-fluorophenyl)propanamide
CID 47097682
N-(2-aminophenyl)-3-(2,5-difluorophenoxy)propanamide
CID 63268657
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide
CID 38765188
3-(2-fluorophenoxy)-N-(2-piperidin-1-ylphenyl)propanamide
CID 2449861
N-(4-chloro-2-fluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 7961385
N-(4-bromophenyl)-3-(2-fluorophenoxy)propanamide
CID 26913928
N-(2,4-difluorophenyl)-3-(2-methoxyanilino)propanamide
CID 109039452
N-(2-fluoro-4-methylphenyl)-2-(2-fluorophenoxy)acetamide
CID 7815061
3-(2-aminophenyl)-N-(2,4-difluorophenyl)propanamide
CID 28714073
3-(2-fluorophenoxy)-N-methoxypropanamide
CID 60717911
N'-(2,4-difluorophenyl)-N-(4-fluorophenyl)butanediamide
CID 670678
N-(2-bromo-4-fluorophenyl)-3-phenoxypropanamide
CID 28938605

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide (CID 51158552) is N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide is O=C(CCOc1ccccc1F)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide?
The InChIKey is JXFKMCFLNIVMHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO2/c16-10-5-6-13(12(18)9-10)19-15(20)7-8-21-14-4-2-1-3-11(14)17/h1-6,9H,7-8H2,(H,19,20).
What are the key properties of N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide?
N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide has a molecular weight of 295.26 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-(2-fluorophenoxy)propanamide is sourced from PubChem (CID 51158552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).