5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one

C8H11NO2 — CID 54707343

IUPAC5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one
SMILESCCc1c(O)cc(=O)[nH]c1C
InChIInChI=1S/C8H11NO2/c1-3-6-5(2)9-8(11)4-7(6)10/h4H,3H2,1-2H3,(H2,9,10,11)
InChIKeySSTDHRRYEGDLAD-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.95
Rot. Bonds1

About 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one

5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one (PubChem CID 54707343) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one
PubChem CID54707343
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one
SMILESCCc1c(O)cc(=O)[nH]c1C
InChIInChI=1S/C8H11NO2/c1-3-6-5(2)9-8(11)4-7(6)10/h4H,3H2,1-2H3,(H2,9,10,11)
InChIKeySSTDHRRYEGDLAD-UHFFFAOYSA-N
XLogP0.95
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one?
The IUPAC name of 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one (CID 54707343) is 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one.
What is the SMILES notation for 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one?
The canonical SMILES for 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one is CCc1c(O)cc(=O)[nH]c1C.
What is the InChIKey of 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one?
The InChIKey is SSTDHRRYEGDLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-3-6-5(2)9-8(11)4-7(6)10/h4H,3H2,1-2H3,(H2,9,10,11).
What are the key properties of 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one?
5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one has a molecular weight of 153.18 g/mol, XLogP of 0.95, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-hydroxy-6-methyl-1H-pyridin-2-one is sourced from PubChem (CID 54707343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).