3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one

C14H24N4O — CID 55156035

IUPAC3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one
SMILESCC(C)n1ccnc(NCCN2CCCCC2)c1=O
InChIInChI=1S/C14H24N4O/c1-12(2)18-11-7-16-13(14(18)19)15-6-10-17-8-4-3-5-9-17/h7,11-12H,3-6,8-10H2,1-2H3,(H,15,16)
InChIKeyPYFBFZBKZNPWKX-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.72
Rot. Bonds5

About 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one

3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one (PubChem CID 55156035) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one.

Molecular Properties

Compound Name3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one
PubChem CID55156035
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one
SMILESCC(C)n1ccnc(NCCN2CCCCC2)c1=O
InChIInChI=1S/C14H24N4O/c1-12(2)18-11-7-16-13(14(18)19)15-6-10-17-8-4-3-5-9-17/h7,11-12H,3-6,8-10H2,1-2H3,(H,15,16)
InChIKeyPYFBFZBKZNPWKX-UHFFFAOYSA-N
XLogP1.72
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-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

1-ethyl-3-(2-piperidin-1-ylethylamino)pyrazin-2-one
CID 62927574
1-propan-2-yl-3-(propylamino)pyrazin-2-one
CID 53015093
3-[2-(cyclopropylamino)ethylamino]-1-propan-2-ylpyrazin-2-one
CID 62928664
3-(ethylamino)-1-propan-2-ylpyrazin-2-one
CID 62938422
1-methyl-3-(2-piperazin-1-ylethylamino)pyrazin-2-one
CID 62938349
3-[2-(1-methylimidazol-2-yl)ethylamino]-1-propan-2-ylpyrazin-2-one
CID 62939874
N-methyl-2-[(3-oxo-4-propan-2-ylpyrazin-2-yl)amino]ethanesulfonamide
CID 106337676
N-[2-[(3-oxo-4-propan-2-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide
CID 62939676
N-[2-(azepan-1-yl)ethyl]-3-methylpyrazin-2-amine
CID 83064744
1-(2-methylpropyl)-N-(2-piperidin-1-ylethyl)imidazol-2-amine
CID 106565060
3-[2-(1-methylpyrazol-3-yl)ethylamino]-1-propan-2-ylpyrazin-2-one
CID 106105480
N-[2-(azepan-1-yl)ethyl]-2-(2-methylimidazol-1-yl)propanamide
CID 119069534

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one?
The IUPAC name of 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one (CID 55156035) is 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one.
What is the SMILES notation for 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one?
The canonical SMILES for 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one is CC(C)n1ccnc(NCCN2CCCCC2)c1=O.
What is the InChIKey of 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one?
The InChIKey is PYFBFZBKZNPWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-12(2)18-11-7-16-13(14(18)19)15-6-10-17-8-4-3-5-9-17/h7,11-12H,3-6,8-10H2,1-2H3,(H,15,16).
What are the key properties of 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one?
3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one has a molecular weight of 264.37 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-1-ylethylamino)-1-propan-2-ylpyrazin-2-one is sourced from PubChem (CID 55156035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).