1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one

C15H14FNO3 — CID 115610630

IUPAC1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one
SMILESCC(=O)c1ccc(OCCn2ccccc2=O)c(F)c1
InChIInChI=1S/C15H14FNO3/c1-11(18)12-5-6-14(13(16)10-12)20-9-8-17-7-3-2-4-15(17)19/h2-7,10H,8-9H2,1H3
InChIKeyGRKDGNDFOGRDML-UHFFFAOYSA-N
MW275.28 g/mol
LogP2.27
Rot. Bonds5

About 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one

1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one (PubChem CID 115610630) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one
PubChem CID115610630
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC Name1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one
SMILESCC(=O)c1ccc(OCCn2ccccc2=O)c(F)c1
InChIInChI=1S/C15H14FNO3/c1-11(18)12-5-6-14(13(16)10-12)20-9-8-17-7-3-2-4-15(17)19/h2-7,10H,8-9H2,1H3
InChIKeyGRKDGNDFOGRDML-UHFFFAOYSA-N
XLogP2.27
TPSA48.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-4-[2-(2-oxo-1-pyridinyl)ethoxy]benzenecarboximidamide
CID 107666698
1-[2-(4-acetylphenoxy)ethyl]pyridin-2-one
CID 78986348
methyl 3-amino-4-[2-(2-oxo-1-pyridinyl)ethoxy]benzoate
CID 82899166
1-[3-fluoro-4-(4-phenylbutoxy)phenyl]ethanone
CID 114333678
1-[2-(2-amino-5-fluorophenoxy)ethyl]pyridin-2-one
CID 82896589
3-(2-oxo-1-pyridinyl)propyl 3,4-difluorobenzoate
CID 56825937
1-[2-[4-(hydroxymethyl)-2-methoxyphenoxy]ethyl]pyridin-2-one
CID 78917301
1-[2-[5-(hydroxymethyl)-2-methoxyphenoxy]ethyl]pyridin-2-one
CID 82897340
1-[2-[(5-acetyl-2-methoxyphenyl)methylsulfonyl]ethyl]pyridin-2-one
CID 167849118
1-[2-[4-chloro-2-(ethylaminomethyl)phenoxy]ethyl]pyridin-2-one
CID 82898441
1-[3-fluoro-4-[(4-fluorophenyl)methoxy]phenyl]ethanone
CID 112689439
2-methyl-4-[2-(2-oxo-1-pyridinyl)ethoxy]benzoic acid
CID 107671050

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one?
The IUPAC name of 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one (CID 115610630) is 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one is CC(=O)c1ccc(OCCn2ccccc2=O)c(F)c1.
What is the InChIKey of 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one?
The InChIKey is GRKDGNDFOGRDML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-11(18)12-5-6-14(13(16)10-12)20-9-8-17-7-3-2-4-15(17)19/h2-7,10H,8-9H2,1H3.
What are the key properties of 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one?
1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one has a molecular weight of 275.28 g/mol, XLogP of 2.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-acetyl-2-fluorophenoxy)ethyl]pyridin-2-one is sourced from PubChem (CID 115610630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).