2-piperidin-4-yl-1H-pyridin-4-one

C10H14N2O — CID 57368509

IUPAC2-piperidin-4-yl-1H-pyridin-4-one
SMILESO=c1cc[nH]c(C2CCNCC2)c1
InChIInChI=1S/C10H14N2O/c13-9-3-6-12-10(7-9)8-1-4-11-5-2-8/h3,6-8,11H,1-2,4-5H2,(H,12,13)
InChIKeyKYYAXUQZDNOJPG-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.84
Rot. Bonds1

About 2-piperidin-4-yl-1H-pyridin-4-one

2-piperidin-4-yl-1H-pyridin-4-one (PubChem CID 57368509) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-piperidin-4-yl-1H-pyridin-4-one.

Molecular Properties

Compound Name2-piperidin-4-yl-1H-pyridin-4-one
PubChem CID57368509
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name2-piperidin-4-yl-1H-pyridin-4-one
SMILESO=c1cc[nH]c(C2CCNCC2)c1
InChIInChI=1S/C10H14N2O/c13-9-3-6-12-10(7-9)8-1-4-11-5-2-8/h3,6-8,11H,1-2,4-5H2,(H,12,13)
InChIKeyKYYAXUQZDNOJPG-UHFFFAOYSA-N
XLogP0.84
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-1H-pyridin-4-one?
The IUPAC name of 2-piperidin-4-yl-1H-pyridin-4-one (CID 57368509) is 2-piperidin-4-yl-1H-pyridin-4-one.
What is the SMILES notation for 2-piperidin-4-yl-1H-pyridin-4-one?
The canonical SMILES for 2-piperidin-4-yl-1H-pyridin-4-one is O=c1cc[nH]c(C2CCNCC2)c1.
What is the InChIKey of 2-piperidin-4-yl-1H-pyridin-4-one?
The InChIKey is KYYAXUQZDNOJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-9-3-6-12-10(7-9)8-1-4-11-5-2-8/h3,6-8,11H,1-2,4-5H2,(H,12,13).
What are the key properties of 2-piperidin-4-yl-1H-pyridin-4-one?
2-piperidin-4-yl-1H-pyridin-4-one has a molecular weight of 178.24 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-1H-pyridin-4-one is sourced from PubChem (CID 57368509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).