5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one

C8H10BrNO2 — CID 54265289

IUPAC5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one
SMILESCCn1c(O)c(Br)c(C)cc1=O
InChIInChI=1S/C8H10BrNO2/c1-3-10-6(11)4-5(2)7(9)8(10)12/h4,12H,3H2,1-2H3
InChIKeyUNFOWPKWEQXXBO-UHFFFAOYSA-N
MW232.08 g/mol
LogP1.64
Rot. Bonds1

About 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one

5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one (PubChem CID 54265289) has the molecular formula C8H10BrNO2 and a molecular weight of 232.08 g/mol. Its IUPAC name is 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one.

Molecular Properties

Compound Name5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one
PubChem CID54265289
Molecular FormulaC8H10BrNO2
Molecular Weight232.08 g/mol
Exact Mass230.99
IUPAC Name5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one
SMILESCCn1c(O)c(Br)c(C)cc1=O
InChIInChI=1S/C8H10BrNO2/c1-3-10-6(11)4-5(2)7(9)8(10)12/h4,12H,3H2,1-2H3
InChIKeyUNFOWPKWEQXXBO-UHFFFAOYSA-N
XLogP1.64
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.08
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-6-hydroxy-4-methylpyridin-2(1H)-one
CID 13643722
5-Bromo-1,4-dimethyl-1,2-dihydropyridin-2-one
CID 67281826
1-Ethyl-5-fluoro-6-hydroxy-4-methylpyridin-2-one
CID 20562291
6-Hydroxy-4-methyl-1-prop-2-enylpyridin-2-one
CID 20043918
6-Hydroxy-4-methyl-1-propylpyridin-2-one
CID 20043919
1-Butyl-6-hydroxy-4-methyl-2(1h)-pyridinone
CID 20043922
1-Ethyl-6-hydroxy-4,5-dimethylpyridin-2-one
CID 20518092
2(1H)-Pyridinone, 6-hydroxy-4-methyl-1-(1-methylethyl)-
CID 20562274
5-Bromo-6-hydroxy-1,4-dimethylpyridin-2-one
CID 20562295
5-Bromo-1-ethyl-4-methylpyridin-2-one
CID 84103132
(5-Bromo-1-methyl-2-oxo-4-pyridinyl)methyl-tert-butylcarbamic acid
CID 139484642
6-Hydroxy-4-methyl-1-(2-methylpropyl)pyridin-2-one
CID 139930393

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The IUPAC name of 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one (CID 54265289) is 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one.
What is the SMILES notation for 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The canonical SMILES for 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one is CCn1c(O)c(Br)c(C)cc1=O.
What is the InChIKey of 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
The InChIKey is UNFOWPKWEQXXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrNO2/c1-3-10-6(11)4-5(2)7(9)8(10)12/h4,12H,3H2,1-2H3.
What are the key properties of 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one?
5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one has a molecular weight of 232.08 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-ethyl-6-hydroxy-4-methylpyridin-2-one is sourced from PubChem (CID 54265289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).