N-ethoxy-2-(2-fluorophenoxy)acetamide

C10H12FNO3 — CID 60712120

IUPACN-ethoxy-2-(2-fluorophenoxy)acetamide
SMILESCCONC(=O)COc1ccccc1F
InChIInChI=1S/C10H12FNO3/c1-2-15-12-10(13)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3,(H,12,13)
InChIKeyNWSROVKXDXKDOS-UHFFFAOYSA-N
MW213.21 g/mol
LogP1.27
Rot. Bonds5

About N-ethoxy-2-(2-fluorophenoxy)acetamide

N-ethoxy-2-(2-fluorophenoxy)acetamide (PubChem CID 60712120) has the molecular formula C10H12FNO3 and a molecular weight of 213.21 g/mol. Its IUPAC name is N-ethoxy-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-ethoxy-2-(2-fluorophenoxy)acetamide
PubChem CID60712120
Molecular FormulaC10H12FNO3
Molecular Weight213.21 g/mol
Exact Mass213.08
IUPAC NameN-ethoxy-2-(2-fluorophenoxy)acetamide
SMILESCCONC(=O)COc1ccccc1F
InChIInChI=1S/C10H12FNO3/c1-2-15-12-10(13)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3,(H,12,13)
InChIKeyNWSROVKXDXKDOS-UHFFFAOYSA-N
XLogP1.27
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.21
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-ethoxy-2-(2-fluorophenoxy)acetamide (CID 60712120) is N-ethoxy-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-ethoxy-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-ethoxy-2-(2-fluorophenoxy)acetamide is CCONC(=O)COc1ccccc1F.
What is the InChIKey of N-ethoxy-2-(2-fluorophenoxy)acetamide?
The InChIKey is NWSROVKXDXKDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO3/c1-2-15-12-10(13)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3,(H,12,13).
What are the key properties of N-ethoxy-2-(2-fluorophenoxy)acetamide?
N-ethoxy-2-(2-fluorophenoxy)acetamide has a molecular weight of 213.21 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 60712120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).