5-(piperazine-1-carbonyl)-1H-pyridin-2-one

C10H13N3O2 — CID 24707425

IUPAC5-(piperazine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCNCC1
InChIInChI=1S/C10H13N3O2/c14-9-2-1-8(7-12-9)10(15)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2,(H,12,14)
InChIKeyOHYMPUVDDALTRH-UHFFFAOYSA-N
MW207.23 g/mol
LogP-0.58
Rot. Bonds1

About 5-(piperazine-1-carbonyl)-1H-pyridin-2-one

5-(piperazine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 24707425) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 5-(piperazine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(piperazine-1-carbonyl)-1H-pyridin-2-one
PubChem CID24707425
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name5-(piperazine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCNCC1
InChIInChI=1S/C10H13N3O2/c14-9-2-1-8(7-12-9)10(15)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2,(H,12,14)
InChIKeyOHYMPUVDDALTRH-UHFFFAOYSA-N
XLogP-0.58
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(piperazine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 5-(piperazine-1-carbonyl)-1H-pyridin-2-one (CID 24707425) is 5-(piperazine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(piperazine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 5-(piperazine-1-carbonyl)-1H-pyridin-2-one is O=C(c1ccc(=O)[nH]c1)N1CCNCC1.
What is the InChIKey of 5-(piperazine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is OHYMPUVDDALTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c14-9-2-1-8(7-12-9)10(15)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2,(H,12,14).
What are the key properties of 5-(piperazine-1-carbonyl)-1H-pyridin-2-one?
5-(piperazine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 207.23 g/mol, XLogP of -0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperazine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 24707425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).