N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide

C11H15FN4O3 — CID 90192926

IUPACN-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide
SMILESCNNC(=O)Nc1cccc(F)c1CONC(C)=O
InChIInChI=1S/C11H15FN4O3/c1-7(17)16-19-6-8-9(12)4-3-5-10(8)14-11(18)15-13-2/h3-5,13H,6H2,1-2H3,(H,16,17)(H2,14,15,18)
InChIKeyMUWJXIIAGMLTSG-UHFFFAOYSA-N
MW270.26 g/mol
LogP0.65
Rot. Bonds5

About N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide

N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide (PubChem CID 90192926) has the molecular formula C11H15FN4O3 and a molecular weight of 270.26 g/mol. Its IUPAC name is N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide.

Molecular Properties

Compound NameN-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide
PubChem CID90192926
Molecular FormulaC11H15FN4O3
Molecular Weight270.26 g/mol
Exact Mass270.11
IUPAC NameN-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide
SMILESCNNC(=O)Nc1cccc(F)c1CONC(C)=O
InChIInChI=1S/C11H15FN4O3/c1-7(17)16-19-6-8-9(12)4-3-5-10(8)14-11(18)15-13-2/h3-5,13H,6H2,1-2H3,(H,16,17)(H2,14,15,18)
InChIKeyMUWJXIIAGMLTSG-UHFFFAOYSA-N
XLogP0.65
TPSA91.49 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 50.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide?
The IUPAC name of N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide (CID 90192926) is N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide.
What is the SMILES notation for N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide?
The canonical SMILES for N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide is CNNC(=O)Nc1cccc(F)c1CONC(C)=O.
What is the InChIKey of N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide?
The InChIKey is MUWJXIIAGMLTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN4O3/c1-7(17)16-19-6-8-9(12)4-3-5-10(8)14-11(18)15-13-2/h3-5,13H,6H2,1-2H3,(H,16,17)(H2,14,15,18).
What are the key properties of N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide?
N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide has a molecular weight of 270.26 g/mol, XLogP of 0.65, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-fluoro-6-(methylaminocarbamoylamino)phenyl]methoxy]acetamide is sourced from PubChem (CID 90192926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).