1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one

C15H14N2O3 — CID 67108584

IUPAC1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one
SMILESO=C1CCCCN1c1ccc(-c2cccnc2)oc1=O
InChIInChI=1S/C15H14N2O3/c18-14-5-1-2-9-17(14)12-6-7-13(20-15(12)19)11-4-3-8-16-10-11/h3-4,6-8,10H,1-2,5,9H2
InChIKeyUVFSHZDNVRBRDQ-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.22
Rot. Bonds2

About 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one

1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one (PubChem CID 67108584) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one.

Molecular Properties

Compound Name1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one
PubChem CID67108584
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one
SMILESO=C1CCCCN1c1ccc(-c2cccnc2)oc1=O
InChIInChI=1S/C15H14N2O3/c18-14-5-1-2-9-17(14)12-6-7-13(20-15(12)19)11-4-3-8-16-10-11/h3-4,6-8,10H,1-2,5,9H2
InChIKeyUVFSHZDNVRBRDQ-UHFFFAOYSA-N
XLogP2.22
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one?
The IUPAC name of 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one (CID 67108584) is 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one.
What is the SMILES notation for 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one?
The canonical SMILES for 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one is O=C1CCCCN1c1ccc(-c2cccnc2)oc1=O.
What is the InChIKey of 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one?
The InChIKey is UVFSHZDNVRBRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c18-14-5-1-2-9-17(14)12-6-7-13(20-15(12)19)11-4-3-8-16-10-11/h3-4,6-8,10H,1-2,5,9H2.
What are the key properties of 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one?
1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one has a molecular weight of 270.29 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-oxo-6-pyridin-3-ylpyran-3-yl)piperidin-2-one is sourced from PubChem (CID 67108584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).