2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide

C11H15FN2O2 — CID 43116060

IUPAC2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide
SMILESCCNC(=O)C(C)Oc1cc(F)ccc1N
InChIInChI=1S/C11H15FN2O2/c1-3-14-11(15)7(2)16-10-6-8(12)4-5-9(10)13/h4-7H,3,13H2,1-2H3,(H,14,15)
InChIKeyODDNVGPYACREQP-UHFFFAOYSA-N
MW226.25 g/mol
LogP1.31
Rot. Bonds4

About 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide

2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide (PubChem CID 43116060) has the molecular formula C11H15FN2O2 and a molecular weight of 226.25 g/mol. Its IUPAC name is 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide.

Molecular Properties

Compound Name2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide
PubChem CID43116060
Molecular FormulaC11H15FN2O2
Molecular Weight226.25 g/mol
Exact Mass226.11
IUPAC Name2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide
SMILESCCNC(=O)C(C)Oc1cc(F)ccc1N
InChIInChI=1S/C11H15FN2O2/c1-3-14-11(15)7(2)16-10-6-8(12)4-5-9(10)13/h4-7H,3,13H2,1-2H3,(H,14,15)
InChIKeyODDNVGPYACREQP-UHFFFAOYSA-N
XLogP1.31
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide?
The IUPAC name of 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide (CID 43116060) is 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide.
What is the SMILES notation for 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide?
The canonical SMILES for 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide is CCNC(=O)C(C)Oc1cc(F)ccc1N.
What is the InChIKey of 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide?
The InChIKey is ODDNVGPYACREQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2/c1-3-14-11(15)7(2)16-10-6-8(12)4-5-9(10)13/h4-7H,3,13H2,1-2H3,(H,14,15).
What are the key properties of 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide?
2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide has a molecular weight of 226.25 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-fluorophenoxy)-N-ethylpropanamide is sourced from PubChem (CID 43116060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).