5-methoxy-2,6-dihydro-1H-pyridin-3-one

C6H9NO2 — CID 13353227

IUPAC5-methoxy-2,6-dihydro-1H-pyridin-3-one
SMILESCOC1=CC(=O)CNC1
InChIInChI=1S/C6H9NO2/c1-9-6-2-5(8)3-7-4-6/h2,7H,3-4H2,1H3
InChIKeyWGLNFNIGXFVAGR-UHFFFAOYSA-N
MW127.14 g/mol
LogP-0.31
Rot. Bonds1

About 5-methoxy-2,6-dihydro-1H-pyridin-3-one

5-methoxy-2,6-dihydro-1H-pyridin-3-one (PubChem CID 13353227) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is 5-methoxy-2,6-dihydro-1H-pyridin-3-one.

Molecular Properties

Compound Name5-methoxy-2,6-dihydro-1H-pyridin-3-one
PubChem CID13353227
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC Name5-methoxy-2,6-dihydro-1H-pyridin-3-one
SMILESCOC1=CC(=O)CNC1
InChIInChI=1S/C6H9NO2/c1-9-6-2-5(8)3-7-4-6/h2,7H,3-4H2,1H3
InChIKeyWGLNFNIGXFVAGR-UHFFFAOYSA-N
XLogP-0.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,6-dihydro-1H-pyridin-3-one?
The IUPAC name of 5-methoxy-2,6-dihydro-1H-pyridin-3-one (CID 13353227) is 5-methoxy-2,6-dihydro-1H-pyridin-3-one.
What is the SMILES notation for 5-methoxy-2,6-dihydro-1H-pyridin-3-one?
The canonical SMILES for 5-methoxy-2,6-dihydro-1H-pyridin-3-one is COC1=CC(=O)CNC1.
What is the InChIKey of 5-methoxy-2,6-dihydro-1H-pyridin-3-one?
The InChIKey is WGLNFNIGXFVAGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c1-9-6-2-5(8)3-7-4-6/h2,7H,3-4H2,1H3.
What are the key properties of 5-methoxy-2,6-dihydro-1H-pyridin-3-one?
5-methoxy-2,6-dihydro-1H-pyridin-3-one has a molecular weight of 127.14 g/mol, XLogP of -0.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,6-dihydro-1H-pyridin-3-one is sourced from PubChem (CID 13353227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).