4-acetyl-6-methyl-1H-pyridin-2-one

C8H9NO2 — CID 11579160

IUPAC4-acetyl-6-methyl-1H-pyridin-2-one
SMILESCC(=O)c1cc(C)[nH]c(=O)c1
InChIInChI=1S/C8H9NO2/c1-5-3-7(6(2)10)4-8(11)9-5/h3-4H,1-2H3,(H,9,11)
InChIKeyJCPDZXJDYRLFMC-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.89
Rot. Bonds1

About 4-acetyl-6-methyl-1H-pyridin-2-one

4-acetyl-6-methyl-1H-pyridin-2-one (PubChem CID 11579160) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 4-acetyl-6-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-acetyl-6-methyl-1H-pyridin-2-one
PubChem CID11579160
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name4-acetyl-6-methyl-1H-pyridin-2-one
SMILESCC(=O)c1cc(C)[nH]c(=O)c1
InChIInChI=1S/C8H9NO2/c1-5-3-7(6(2)10)4-8(11)9-5/h3-4H,1-2H3,(H,9,11)
InChIKeyJCPDZXJDYRLFMC-UHFFFAOYSA-N
XLogP0.89
TPSA49.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-acetyl-6-methyl-1H-pyridin-2-one?
The IUPAC name of 4-acetyl-6-methyl-1H-pyridin-2-one (CID 11579160) is 4-acetyl-6-methyl-1H-pyridin-2-one.
What is the SMILES notation for 4-acetyl-6-methyl-1H-pyridin-2-one?
The canonical SMILES for 4-acetyl-6-methyl-1H-pyridin-2-one is CC(=O)c1cc(C)[nH]c(=O)c1.
What is the InChIKey of 4-acetyl-6-methyl-1H-pyridin-2-one?
The InChIKey is JCPDZXJDYRLFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-5-3-7(6(2)10)4-8(11)9-5/h3-4H,1-2H3,(H,9,11).
What are the key properties of 4-acetyl-6-methyl-1H-pyridin-2-one?
4-acetyl-6-methyl-1H-pyridin-2-one has a molecular weight of 151.16 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-6-methyl-1H-pyridin-2-one is sourced from PubChem (CID 11579160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).