1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide

C8H10FN3O2 — CID 107018024

IUPAC1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide
SMILESN/C(=N/O)c1cccn(CCF)c1=O
InChIInChI=1S/C8H10FN3O2/c9-3-5-12-4-1-2-6(8(12)13)7(10)11-14/h1-2,4,14H,3,5H2,(H2,10,11)
InChIKeyGAOYXVYVNSQQJI-UHFFFAOYSA-N
MW199.19 g/mol
LogP-0.09
Rot. Bonds3

About 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide

1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide (PubChem CID 107018024) has the molecular formula C8H10FN3O2 and a molecular weight of 199.19 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide.

Molecular Properties

Compound Name1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide
PubChem CID107018024
Molecular FormulaC8H10FN3O2
Molecular Weight199.19 g/mol
Exact Mass199.08
IUPAC Name1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide
SMILESN/C(=N/O)c1cccn(CCF)c1=O
InChIInChI=1S/C8H10FN3O2/c9-3-5-12-4-1-2-6(8(12)13)7(10)11-14/h1-2,4,14H,3,5H2,(H2,10,11)
InChIKeyGAOYXVYVNSQQJI-UHFFFAOYSA-N
XLogP-0.09
TPSA80.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.19
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Related Compounds

3-[Amino(hydroxyamino)methylidene]-2,3-dihydropyridin-2-one
CID 135966539
N'-2-Dihydroxynicotinimidamide
CID 136267853
CID 136133844
CID 136133844
N'-hydroxy-2-oxo-1-(2,2,2-trifluoroethyl)pyridine-3-carboximidamide
CID 107017955
1-(2,2-difluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide
CID 107017967
N'-hydroxy-2-oxo-1-[3-(2,2,2-trifluoroethoxy)propyl]pyridine-3-carboximidamide
CID 107017970
N'-hydroxy-2-oxo-1-(3,3,3-trifluoropropyl)pyridine-3-carboximidamide
CID 107018007
N'-hydroxy-2-oxo-1-[2-(trifluoromethylsulfanyl)ethyl]pyridine-3-carboximidamide
CID 107018011
N'-hydroxy-2-oxo-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyridine-3-carboximidamide
CID 107018026
1-(3-fluoropropyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide
CID 107018041
N'-hydroxy-2-oxo-1-[2-(trifluoromethoxy)ethyl]pyridine-3-carboximidamide
CID 107018134
N'-hydroxy-6-methyl-2-oxo-1-(2,2,2-trifluoroethyl)pyridine-3-carboximidamide
CID 107073507

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide?
The IUPAC name of 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide (CID 107018024) is 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide.
What is the SMILES notation for 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide?
The canonical SMILES for 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide is N/C(=N/O)c1cccn(CCF)c1=O.
What is the InChIKey of 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide?
The InChIKey is GAOYXVYVNSQQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3O2/c9-3-5-12-4-1-2-6(8(12)13)7(10)11-14/h1-2,4,14H,3,5H2,(H2,10,11).
What are the key properties of 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide?
1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide has a molecular weight of 199.19 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-N'-hydroxy-2-oxopyridine-3-carboximidamide is sourced from PubChem (CID 107018024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).