N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide

C13H17F2NO3 — CID 60546289

IUPACN-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCOC(C)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H17F2NO3/c1-3-18-6-7-19-9(2)13(17)16-12-5-4-10(14)8-11(12)15/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,17)
InChIKeyQTSNJGFEKOGTEB-UHFFFAOYSA-N
MW273.28 g/mol
LogP2.34
Rot. Bonds7

About N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide

N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide (PubChem CID 60546289) has the molecular formula C13H17F2NO3 and a molecular weight of 273.28 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide
PubChem CID60546289
Molecular FormulaC13H17F2NO3
Molecular Weight273.28 g/mol
Exact Mass273.12
IUPAC NameN-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCOC(C)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H17F2NO3/c1-3-18-6-7-19-9(2)13(17)16-12-5-4-10(14)8-11(12)15/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,17)
InChIKeyQTSNJGFEKOGTEB-UHFFFAOYSA-N
XLogP2.34
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.28
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-fluorophenyl)-2-(2-hydroxyethoxy)propanamide
CID 43823331
N-(2,4-difluorophenyl)-2-methylpentanamide
CID 2904798
2-amino-N-(2,4-difluorophenyl)butanamide
CID 43649437
N-(2-tert-butylphenyl)-2-(2-ethoxyethoxy)propanamide
CID 60546063
N-(2-amino-5-methoxyphenyl)-2-(2-ethoxyethoxy)propanamide
CID 119421324
(2R)-2-(2-ethoxyethoxy)-N-[3-fluoro-4-(2-methylimidazol-1-yl)phenyl]propanamide
CID 94675288
[1-(2,4-difluoroanilino)-1-oxopropan-2-yl] 4-bromobenzoate
CID 46619659
N-(2,4-difluorophenyl)-2-(4-methoxyphenoxy)butanamide
CID 53281950
1-(2,4-difluorophenyl)-3-pentan-3-ylurea
CID 6469007
1-(2,4-difluorophenyl)-3-(2-methoxyethoxymethyl)urea
CID 108894556
N-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 53286451
2-(2-ethoxyethoxy)-N-[4-(methylcarbamoylamino)phenyl]propanamide
CID 47078303

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide (CID 60546289) is N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide is CCOCCOC(C)C(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide?
The InChIKey is QTSNJGFEKOGTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F2NO3/c1-3-18-6-7-19-9(2)13(17)16-12-5-4-10(14)8-11(12)15/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,17).
What are the key properties of N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide?
N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide has a molecular weight of 273.28 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)propanamide is sourced from PubChem (CID 60546289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).