6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one

C9H12FNO2 — CID 178099649

IUPAC6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one
SMILESCOCCn1c(F)ccc(C)c1=O
InChIInChI=1S/C9H12FNO2/c1-7-3-4-8(10)11(9(7)12)5-6-13-2/h3-4H,5-6H2,1-2H3
InChIKeyOUJKFXMUZKTUPL-UHFFFAOYSA-N
MW185.20 g/mol
LogP0.94
Rot. Bonds3

About 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one

6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one (PubChem CID 178099649) has the molecular formula C9H12FNO2 and a molecular weight of 185.20 g/mol. Its IUPAC name is 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one.

Molecular Properties

Compound Name6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one
PubChem CID178099649
Molecular FormulaC9H12FNO2
Molecular Weight185.20 g/mol
Exact Mass185.09
IUPAC Name6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one
SMILESCOCCn1c(F)ccc(C)c1=O
InChIInChI=1S/C9H12FNO2/c1-7-3-4-8(10)11(9(7)12)5-6-13-2/h3-4H,5-6H2,1-2H3
InChIKeyOUJKFXMUZKTUPL-UHFFFAOYSA-N
XLogP0.94
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.20
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-Oxo-3-(trifluoromethyl)pyridin-1-yl]ethyl acetate
CID 150475288
1-Ethyl-6-fluoro-3-methylpyridin-2-one
CID 153566332
1-(2-Methoxyethyl)-3-methyl-5-(trifluoromethyl)pyridin-2-one
CID 166833878
5-Bromo-1-(2-methoxyethyl)-3-(trifluoromethyl)pyridin-2-one
CID 169095666
6-Fluoro-1-(2-methoxyethyl)-3-propan-2-ylpyridin-2-one
CID 178099296
(2Z)-2-methyl-1-morpholin-4-ylpenta-2,4-dien-1-one
CID 24899376
3-Methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-one
CID 75484380
Ethyl 2-fluoro-2-(3-methyl-2-oxo-1-pyridinyl)acetate
CID 81298513
5-Bromo-3-methyl-1-[2-(trifluoromethoxy)ethyl]pyridin-2-one
CID 83132804
5-Bromo-3-methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-one
CID 83133222
5-Fluoro-1-(2-methoxyethyl)pyridin-2-one
CID 84314088
3-Methyl-1-[2-(2,2,3,3-tetrafluoropropoxy)ethyl]pyridin-2-one
CID 91651237

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one?
The IUPAC name of 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one (CID 178099649) is 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one.
What is the SMILES notation for 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one?
The canonical SMILES for 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one is COCCn1c(F)ccc(C)c1=O.
What is the InChIKey of 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one?
The InChIKey is OUJKFXMUZKTUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FNO2/c1-7-3-4-8(10)11(9(7)12)5-6-13-2/h3-4H,5-6H2,1-2H3.
What are the key properties of 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one?
6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one has a molecular weight of 185.20 g/mol, XLogP of 0.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-(2-methoxyethyl)-3-methylpyridin-2-one is sourced from PubChem (CID 178099649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).