2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide

C11H13FN2O3 — CID 4690424

IUPAC2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C11H13FN2O3/c1-7(10(15)14-11(16)13-2)17-9-6-4-3-5-8(9)12/h3-7H,1-2H3,(H2,13,14,15,16)
InChIKeyDSNALRHFGMSUTF-UHFFFAOYSA-N
MW240.23 g/mol
LogP1.05
Rot. Bonds3

About 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide

2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide (PubChem CID 4690424) has the molecular formula C11H13FN2O3 and a molecular weight of 240.23 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide
PubChem CID4690424
Molecular FormulaC11H13FN2O3
Molecular Weight240.23 g/mol
Exact Mass240.09
IUPAC Name2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C11H13FN2O3/c1-7(10(15)14-11(16)13-2)17-9-6-4-3-5-8(9)12/h3-7H,1-2H3,(H2,13,14,15,16)
InChIKeyDSNALRHFGMSUTF-UHFFFAOYSA-N
XLogP1.05
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.23
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide (CID 4690424) is 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)C(C)Oc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide?
The InChIKey is DSNALRHFGMSUTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O3/c1-7(10(15)14-11(16)13-2)17-9-6-4-3-5-8(9)12/h3-7H,1-2H3,(H2,13,14,15,16).
What are the key properties of 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide?
2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide has a molecular weight of 240.23 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 4690424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).