3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one

C11H15N3O2 — CID 114570684

IUPAC3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one
SMILESCC(=O)C1CCCN(c2ncc[nH]c2=O)C1
InChIInChI=1S/C11H15N3O2/c1-8(15)9-3-2-6-14(7-9)10-11(16)13-5-4-12-10/h4-5,9H,2-3,6-7H2,1H3,(H,13,16)
InChIKeyWQZSQJGMDPGLLZ-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.58
Rot. Bonds2

About 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one

3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one (PubChem CID 114570684) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one
PubChem CID114570684
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one
SMILESCC(=O)C1CCCN(c2ncc[nH]c2=O)C1
InChIInChI=1S/C11H15N3O2/c1-8(15)9-3-2-6-14(7-9)10-11(16)13-5-4-12-10/h4-5,9H,2-3,6-7H2,1H3,(H,13,16)
InChIKeyWQZSQJGMDPGLLZ-UHFFFAOYSA-N
XLogP0.58
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-Acetyl-3-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 54448739
3-(4-acetylpiperidin-1-yl)-5-bromo-1H-pyrazin-2-one
CID 157980796
1-Methyl-3-(2-piperidin-3-ylethylamino)pyrazin-2-one
CID 55247451
3-(3-Acetylpiperidin-1-yl)-1-ethylpyrazin-2-one
CID 55257188
3-(4-Acetylpiperidin-1-yl)-1-methylpyrazin-2-one
CID 55258343
N-(2-aminoethyl)-1-(4-methyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide
CID 63252809
N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide
CID 63252848
3-(3-Acetylpiperidin-1-yl)-1-tert-butylpyrazin-2-one
CID 63844436
3-(3-Acetylpiperidin-1-yl)-1-propan-2-ylpyrazin-2-one
CID 63845489
3-(3-Acetylpiperidin-1-yl)-1-cyclopropylpyrazin-2-one
CID 63845994
3-(3-Acetylpiperidin-1-yl)-1-propylpyrazin-2-one
CID 63845996
3-(3-Acetylpiperidin-1-yl)-1-methylpyrazin-2-one
CID 63845997

Frequently Asked Questions

What is the IUPAC name of 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one?
The IUPAC name of 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one (CID 114570684) is 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one.
What is the SMILES notation for 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one?
The canonical SMILES for 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one is CC(=O)C1CCCN(c2ncc[nH]c2=O)C1.
What is the InChIKey of 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one?
The InChIKey is WQZSQJGMDPGLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-8(15)9-3-2-6-14(7-9)10-11(16)13-5-4-12-10/h4-5,9H,2-3,6-7H2,1H3,(H,13,16).
What are the key properties of 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one?
3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one has a molecular weight of 221.26 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-acetylpiperidin-1-yl)-1H-pyrazin-2-one is sourced from PubChem (CID 114570684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).