5-ethyl-4,6-dimethyl-1H-pyridin-2-one

C9H13NO — CID 12589334

IUPAC5-ethyl-4,6-dimethyl-1H-pyridin-2-one
SMILESCCc1c(C)cc(=O)[nH]c1C
InChIInChI=1S/C9H13NO/c1-4-8-6(2)5-9(11)10-7(8)3/h5H,4H2,1-3H3,(H,10,11)
InChIKeyWVMLBUYPCHTSBQ-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.55
Rot. Bonds1

About 5-ethyl-4,6-dimethyl-1H-pyridin-2-one

5-ethyl-4,6-dimethyl-1H-pyridin-2-one (PubChem CID 12589334) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 5-ethyl-4,6-dimethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-ethyl-4,6-dimethyl-1H-pyridin-2-one
PubChem CID12589334
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name5-ethyl-4,6-dimethyl-1H-pyridin-2-one
SMILESCCc1c(C)cc(=O)[nH]c1C
InChIInChI=1S/C9H13NO/c1-4-8-6(2)5-9(11)10-7(8)3/h5H,4H2,1-3H3,(H,10,11)
InChIKeyWVMLBUYPCHTSBQ-UHFFFAOYSA-N
XLogP1.55
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,8-Dimethylisoquinolin-3-ol
CID 3238513
1,6-Dimethylisoquinolin-3-ol
CID 3240963
4-methyl-1H,2H,5H,6H,7H-cyclopenta[b]pyridin-2-one
CID 289262
1-Methylisoquinolin-3-ol
CID 3242031
3-Amino-5-ethyl-6-methyl-1H-pyridin-2-one
CID 481022
Pulchellalactam
CID 10261263
Streptokordin
CID 11579160
1,6,8-Trimethylisoquinolin-3-ol
CID 3237710
4,6-Dimethylpyridin-2-ol
CID 226288
4,6-dimethyl-2-oxo-5-prop-2-enyl-1H-pyridine-3-carbonitrile
CID 2728467
5,6-Dimethyl-2-pyridone
CID 119785
8-ethenyl-1-ethyl-6,7-difluoro-2H-isoquinolin-3-one
CID 178101186

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4,6-dimethyl-1H-pyridin-2-one?
The IUPAC name of 5-ethyl-4,6-dimethyl-1H-pyridin-2-one (CID 12589334) is 5-ethyl-4,6-dimethyl-1H-pyridin-2-one.
What is the SMILES notation for 5-ethyl-4,6-dimethyl-1H-pyridin-2-one?
The canonical SMILES for 5-ethyl-4,6-dimethyl-1H-pyridin-2-one is CCc1c(C)cc(=O)[nH]c1C.
What is the InChIKey of 5-ethyl-4,6-dimethyl-1H-pyridin-2-one?
The InChIKey is WVMLBUYPCHTSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-4-8-6(2)5-9(11)10-7(8)3/h5H,4H2,1-3H3,(H,10,11).
What are the key properties of 5-ethyl-4,6-dimethyl-1H-pyridin-2-one?
5-ethyl-4,6-dimethyl-1H-pyridin-2-one has a molecular weight of 151.21 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4,6-dimethyl-1H-pyridin-2-one is sourced from PubChem (CID 12589334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).