3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one

C11H14N2O3 — CID 43391733

IUPAC3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc[nH]c1=O)N1CCC(O)CC1
InChIInChI=1S/C11H14N2O3/c14-8-3-6-13(7-4-8)11(16)9-2-1-5-12-10(9)15/h1-2,5,8,14H,3-4,6-7H2,(H,12,15)
InChIKeyFJAARCWGPAEJJQ-UHFFFAOYSA-N
MW222.24 g/mol
LogP-0.03
Rot. Bonds1

About 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one

3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 43391733) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one
PubChem CID43391733
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc[nH]c1=O)N1CCC(O)CC1
InChIInChI=1S/C11H14N2O3/c14-8-3-6-13(7-4-8)11(16)9-2-1-5-12-10(9)15/h1-2,5,8,14H,3-4,6-7H2,(H,12,15)
InChIKeyFJAARCWGPAEJJQ-UHFFFAOYSA-N
XLogP-0.03
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one (CID 43391733) is 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one is O=C(c1ccc[nH]c1=O)N1CCC(O)CC1.
What is the InChIKey of 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is FJAARCWGPAEJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c14-8-3-6-13(7-4-8)11(16)9-2-1-5-12-10(9)15/h1-2,5,8,14H,3-4,6-7H2,(H,12,15).
What are the key properties of 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one?
3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 222.24 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxypiperidine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 43391733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).