4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one

C8H13NO2 — CID 10678456

IUPAC4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
SMILESCCOC1=CC(=O)NC(C)C1
InChIInChI=1S/C8H13NO2/c1-3-11-7-4-6(2)9-8(10)5-7/h5-6H,3-4H2,1-2H3,(H,9,10)
InChIKeyNLJUTUPZAZZXID-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.82
Rot. Bonds2

About 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one

4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one (PubChem CID 10678456) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one.

Molecular Properties

Compound Name4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
PubChem CID10678456
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
SMILESCCOC1=CC(=O)NC(C)C1
InChIInChI=1S/C8H13NO2/c1-3-11-7-4-6(2)9-8(10)5-7/h5-6H,3-4H2,1-2H3,(H,9,10)
InChIKeyNLJUTUPZAZZXID-UHFFFAOYSA-N
XLogP0.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one?
The IUPAC name of 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one (CID 10678456) is 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one.
What is the SMILES notation for 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one?
The canonical SMILES for 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one is CCOC1=CC(=O)NC(C)C1.
What is the InChIKey of 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one?
The InChIKey is NLJUTUPZAZZXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-11-7-4-6(2)9-8(10)5-7/h5-6H,3-4H2,1-2H3,(H,9,10).
What are the key properties of 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one?
4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one has a molecular weight of 155.20 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one is sourced from PubChem (CID 10678456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).