3,5-diethyl-2-methyl-1H-pyridin-4-one

C10H15NO — CID 91490642

IUPAC3,5-diethyl-2-methyl-1H-pyridin-4-one
SMILESCCc1c[nH]c(C)c(CC)c1=O
InChIInChI=1S/C10H15NO/c1-4-8-6-11-7(3)9(5-2)10(8)12/h6H,4-5H2,1-3H3,(H,11,12)
InChIKeySWYHQZSUFKGOIZ-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.81
Rot. Bonds2

About 3,5-diethyl-2-methyl-1H-pyridin-4-one

3,5-diethyl-2-methyl-1H-pyridin-4-one (PubChem CID 91490642) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 3,5-diethyl-2-methyl-1H-pyridin-4-one.

Molecular Properties

Compound Name3,5-diethyl-2-methyl-1H-pyridin-4-one
PubChem CID91490642
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name3,5-diethyl-2-methyl-1H-pyridin-4-one
SMILESCCc1c[nH]c(C)c(CC)c1=O
InChIInChI=1S/C10H15NO/c1-4-8-6-11-7(3)9(5-2)10(8)12/h6H,4-5H2,1-3H3,(H,11,12)
InChIKeySWYHQZSUFKGOIZ-UHFFFAOYSA-N
XLogP1.81
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-2-methyl-1H-pyridin-4-one?
The IUPAC name of 3,5-diethyl-2-methyl-1H-pyridin-4-one (CID 91490642) is 3,5-diethyl-2-methyl-1H-pyridin-4-one.
What is the SMILES notation for 3,5-diethyl-2-methyl-1H-pyridin-4-one?
The canonical SMILES for 3,5-diethyl-2-methyl-1H-pyridin-4-one is CCc1c[nH]c(C)c(CC)c1=O.
What is the InChIKey of 3,5-diethyl-2-methyl-1H-pyridin-4-one?
The InChIKey is SWYHQZSUFKGOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-8-6-11-7(3)9(5-2)10(8)12/h6H,4-5H2,1-3H3,(H,11,12).
What are the key properties of 3,5-diethyl-2-methyl-1H-pyridin-4-one?
3,5-diethyl-2-methyl-1H-pyridin-4-one has a molecular weight of 165.24 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-2-methyl-1H-pyridin-4-one is sourced from PubChem (CID 91490642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).