1-ethyl-5-methoxypyridin-2-one

C8H11NO2 — CID 141374683

IUPAC1-ethyl-5-methoxypyridin-2-one
SMILESCCn1cc(OC)ccc1=O
InChIInChI=1S/C8H11NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h4-6H,3H2,1-2H3
InChIKeyLOEJYBGTOWJASS-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.88
Rot. Bonds2

About 1-ethyl-5-methoxypyridin-2-one

1-ethyl-5-methoxypyridin-2-one (PubChem CID 141374683) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 1-ethyl-5-methoxypyridin-2-one.

Molecular Properties

Compound Name1-ethyl-5-methoxypyridin-2-one
PubChem CID141374683
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name1-ethyl-5-methoxypyridin-2-one
SMILESCCn1cc(OC)ccc1=O
InChIInChI=1S/C8H11NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h4-6H,3H2,1-2H3
InChIKeyLOEJYBGTOWJASS-UHFFFAOYSA-N
XLogP0.88
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methoxypyridin-2-one?
The IUPAC name of 1-ethyl-5-methoxypyridin-2-one (CID 141374683) is 1-ethyl-5-methoxypyridin-2-one.
What is the SMILES notation for 1-ethyl-5-methoxypyridin-2-one?
The canonical SMILES for 1-ethyl-5-methoxypyridin-2-one is CCn1cc(OC)ccc1=O.
What is the InChIKey of 1-ethyl-5-methoxypyridin-2-one?
The InChIKey is LOEJYBGTOWJASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h4-6H,3H2,1-2H3.
What are the key properties of 1-ethyl-5-methoxypyridin-2-one?
1-ethyl-5-methoxypyridin-2-one has a molecular weight of 153.18 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methoxypyridin-2-one is sourced from PubChem (CID 141374683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).