2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide

C8H9FN2O2 — CID 115371615

IUPAC2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide
SMILESCNC(=O)COc1ccc(F)nc1
InChIInChI=1S/C8H9FN2O2/c1-10-8(12)5-13-6-2-3-7(9)11-4-6/h2-4H,5H2,1H3,(H,10,12)
InChIKeyOSQBMTOEWVMRJK-UHFFFAOYSA-N
MW184.17 g/mol
LogP0.35
Rot. Bonds3

About 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide

2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide (PubChem CID 115371615) has the molecular formula C8H9FN2O2 and a molecular weight of 184.17 g/mol. Its IUPAC name is 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide.

Molecular Properties

Compound Name2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide
PubChem CID115371615
Molecular FormulaC8H9FN2O2
Molecular Weight184.17 g/mol
Exact Mass184.06
IUPAC Name2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide
SMILESCNC(=O)COc1ccc(F)nc1
InChIInChI=1S/C8H9FN2O2/c1-10-8(12)5-13-6-2-3-7(9)11-4-6/h2-4H,5H2,1H3,(H,10,12)
InChIKeyOSQBMTOEWVMRJK-UHFFFAOYSA-N
XLogP0.35
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.17
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[(6-fluoro-3-pyridinyl)oxy]-N-propylacetamide
CID 115371607
2-[(6-fluoro-3-pyridinyl)oxy]-N-(2-methylbutan-2-yl)acetamide
CID 115282956
ethyl 2-[[2-[(6-fluoro-3-pyridinyl)oxy]acetyl]amino]acetate
CID 166386485
2-(4-methoxyphenoxy)-N-methylacetamide
CID 606867
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]-N-methylacetamide
CID 79799713
2-[4-(3,5-difluorophenyl)phenoxy]-N-methylacetamide
CID 72885050
N-(6-fluoro-3-pyridinyl)-2-phenoxyacetamide
CID 103789815
2-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-N-methylacetamide
CID 107716600
2-[(6-fluoro-3-pyridinyl)oxy]-N-(methylcarbamoyl)propanamide
CID 115371762
2-[4-[[(5-chloro-3-fluoro-2-pyridinyl)amino]methyl]phenoxy]-N-methylacetamide
CID 86778558
2-[[6-(methylcarbamoyl)-3-pyridinyl]oxy]acetic acid
CID 119086981
2-[4-[4-(aminomethyl)phenyl]phenoxy]-N-methylacetamide
CID 43366442

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide?
The IUPAC name of 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide (CID 115371615) is 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide.
What is the SMILES notation for 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide?
The canonical SMILES for 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide is CNC(=O)COc1ccc(F)nc1.
What is the InChIKey of 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide?
The InChIKey is OSQBMTOEWVMRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O2/c1-10-8(12)5-13-6-2-3-7(9)11-4-6/h2-4H,5H2,1H3,(H,10,12).
What are the key properties of 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide?
2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide has a molecular weight of 184.17 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide is sourced from PubChem (CID 115371615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).