6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one

C10H15N3O — CID 59768158

IUPAC6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one
SMILESCN1CCN(c2cccc(=O)[nH]2)CC1
InChIInChI=1S/C10H15N3O/c1-12-5-7-13(8-6-12)9-3-2-4-10(14)11-9/h2-4H,5-8H2,1H3,(H,11,14)
InChIKeyITTKUWLVZNLFGU-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.13
Rot. Bonds1

About 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one

6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one (PubChem CID 59768158) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one
PubChem CID59768158
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one
SMILESCN1CCN(c2cccc(=O)[nH]2)CC1
InChIInChI=1S/C10H15N3O/c1-12-5-7-13(8-6-12)9-3-2-4-10(14)11-9/h2-4H,5-8H2,1H3,(H,11,14)
InChIKeyITTKUWLVZNLFGU-UHFFFAOYSA-N
XLogP0.13
TPSA39.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one?
The IUPAC name of 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one (CID 59768158) is 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one?
The canonical SMILES for 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one is CN1CCN(c2cccc(=O)[nH]2)CC1.
What is the InChIKey of 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one?
The InChIKey is ITTKUWLVZNLFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-12-5-7-13(8-6-12)9-3-2-4-10(14)11-9/h2-4H,5-8H2,1H3,(H,11,14).
What are the key properties of 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one?
6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperazin-1-yl)-1H-pyridin-2-one is sourced from PubChem (CID 59768158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).