1-ethyl-3,4,5,6-tetramethylpyridin-2-one

C11H17NO — CID 22093020

IUPAC1-ethyl-3,4,5,6-tetramethylpyridin-2-one
SMILESCCn1c(C)c(C)c(C)c(C)c1=O
InChIInChI=1S/C11H17NO/c1-6-12-10(5)8(3)7(2)9(4)11(12)13/h6H2,1-5H3
InChIKeyVDZPCTWKZQMCJB-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.10
Rot. Bonds1

About 1-ethyl-3,4,5,6-tetramethylpyridin-2-one

1-ethyl-3,4,5,6-tetramethylpyridin-2-one (PubChem CID 22093020) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 1-ethyl-3,4,5,6-tetramethylpyridin-2-one.

Molecular Properties

Compound Name1-ethyl-3,4,5,6-tetramethylpyridin-2-one
PubChem CID22093020
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name1-ethyl-3,4,5,6-tetramethylpyridin-2-one
SMILESCCn1c(C)c(C)c(C)c(C)c1=O
InChIInChI=1S/C11H17NO/c1-6-12-10(5)8(3)7(2)9(4)11(12)13/h6H2,1-5H3
InChIKeyVDZPCTWKZQMCJB-UHFFFAOYSA-N
XLogP2.10
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3,4,5,6-Pentamethyl-2(1H)-pyridinone
CID 586035
2(1H)-Pyridinone, 1-cyclohexyl-3,4,5,6-tetramethyl-
CID 592036
1-ethyl-4,6-dimethyl-2(1H)-pyridone
CID 21538594
1-Ethyl-3,4-dimethyl-6-(trifluoromethyl)pyridin-2-one
CID 145311455
3-Ethyl-1,4,6-trimethyl-5-(trifluoromethyl)pyridin-2-one
CID 146630370
1,4,5-Trimethyl-2,3-dihydropyridin-6-one
CID 15981614
1-Butyl-3,5-dimethylpyridin-2-one
CID 13169253
5-Ethyl-3-methyl-1-propylpyridin-2-one
CID 13169256
copper(1+);N,N-diethyl-4-methylbenzene-6-ide-1-carboxamide
CID 134858453
4,6-Dimethyl-1-(3-methylbutan-2-yl)pyridin-2-one
CID 85865949
4,6-Dimethyl-1-prop-2-enylpyridin-2-one
CID 86080282
N,N,3-triethyl-2-methylpent-2-enamide
CID 102303654

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,4,5,6-tetramethylpyridin-2-one?
The IUPAC name of 1-ethyl-3,4,5,6-tetramethylpyridin-2-one (CID 22093020) is 1-ethyl-3,4,5,6-tetramethylpyridin-2-one.
What is the SMILES notation for 1-ethyl-3,4,5,6-tetramethylpyridin-2-one?
The canonical SMILES for 1-ethyl-3,4,5,6-tetramethylpyridin-2-one is CCn1c(C)c(C)c(C)c(C)c1=O.
What is the InChIKey of 1-ethyl-3,4,5,6-tetramethylpyridin-2-one?
The InChIKey is VDZPCTWKZQMCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-6-12-10(5)8(3)7(2)9(4)11(12)13/h6H2,1-5H3.
What are the key properties of 1-ethyl-3,4,5,6-tetramethylpyridin-2-one?
1-ethyl-3,4,5,6-tetramethylpyridin-2-one has a molecular weight of 179.26 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,4,5,6-tetramethylpyridin-2-one is sourced from PubChem (CID 22093020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).