2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide

C13H10F2N2O2 — CID 79519799

IUPAC2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide
SMILESNC(=NO)c1c(F)cccc1Oc1ccc(F)cc1
InChIInChI=1S/C13H10F2N2O2/c14-8-4-6-9(7-5-8)19-11-3-1-2-10(15)12(11)13(16)17-18/h1-7,18H,(H2,16,17)
InChIKeyBCZSVAWMKZLODL-UHFFFAOYSA-N
MW264.23 g/mol
LogP2.85
Rot. Bonds3

About 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide

2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide (PubChem CID 79519799) has the molecular formula C13H10F2N2O2 and a molecular weight of 264.23 g/mol. Its IUPAC name is 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide.

Molecular Properties

Compound Name2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide
PubChem CID79519799
Molecular FormulaC13H10F2N2O2
Molecular Weight264.23 g/mol
Exact Mass264.07
IUPAC Name2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide
SMILESNC(=NO)c1c(F)cccc1Oc1ccc(F)cc1
InChIInChI=1S/C13H10F2N2O2/c14-8-4-6-9(7-5-8)19-11-3-1-2-10(15)12(11)13(16)17-18/h1-7,18H,(H2,16,17)
InChIKeyBCZSVAWMKZLODL-UHFFFAOYSA-N
XLogP2.85
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide?
The IUPAC name of 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide (CID 79519799) is 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide.
What is the SMILES notation for 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide?
The canonical SMILES for 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide is NC(=NO)c1c(F)cccc1Oc1ccc(F)cc1.
What is the InChIKey of 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide?
The InChIKey is BCZSVAWMKZLODL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O2/c14-8-4-6-9(7-5-8)19-11-3-1-2-10(15)12(11)13(16)17-18/h1-7,18H,(H2,16,17).
What are the key properties of 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide?
2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide has a molecular weight of 264.23 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(4-fluorophenoxy)-N'-hydroxybenzenecarboximidamide is sourced from PubChem (CID 79519799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).