1-methyl-3-piperidin-4-yloxypyridin-4-one

C11H16N2O2 — CID 84676151

IUPAC1-methyl-3-piperidin-4-yloxypyridin-4-one
SMILESCn1ccc(=O)c(OC2CCNCC2)c1
InChIInChI=1S/C11H16N2O2/c1-13-7-4-10(14)11(8-13)15-9-2-5-12-6-3-9/h4,7-9,12H,2-3,5-6H2,1H3
InChIKeyKPVKNPNUVLOZPP-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.52
Rot. Bonds2

About 1-methyl-3-piperidin-4-yloxypyridin-4-one

1-methyl-3-piperidin-4-yloxypyridin-4-one (PubChem CID 84676151) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-methyl-3-piperidin-4-yloxypyridin-4-one.

Molecular Properties

Compound Name1-methyl-3-piperidin-4-yloxypyridin-4-one
PubChem CID84676151
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-methyl-3-piperidin-4-yloxypyridin-4-one
SMILESCn1ccc(=O)c(OC2CCNCC2)c1
InChIInChI=1S/C11H16N2O2/c1-13-7-4-10(14)11(8-13)15-9-2-5-12-6-3-9/h4,7-9,12H,2-3,5-6H2,1H3
InChIKeyKPVKNPNUVLOZPP-UHFFFAOYSA-N
XLogP0.52
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-piperidin-4-yloxypyridin-4-one?
The IUPAC name of 1-methyl-3-piperidin-4-yloxypyridin-4-one (CID 84676151) is 1-methyl-3-piperidin-4-yloxypyridin-4-one.
What is the SMILES notation for 1-methyl-3-piperidin-4-yloxypyridin-4-one?
The canonical SMILES for 1-methyl-3-piperidin-4-yloxypyridin-4-one is Cn1ccc(=O)c(OC2CCNCC2)c1.
What is the InChIKey of 1-methyl-3-piperidin-4-yloxypyridin-4-one?
The InChIKey is KPVKNPNUVLOZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-13-7-4-10(14)11(8-13)15-9-2-5-12-6-3-9/h4,7-9,12H,2-3,5-6H2,1H3.
What are the key properties of 1-methyl-3-piperidin-4-yloxypyridin-4-one?
1-methyl-3-piperidin-4-yloxypyridin-4-one has a molecular weight of 208.26 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-piperidin-4-yloxypyridin-4-one is sourced from PubChem (CID 84676151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).