5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one

C14H20N4O2 — CID 60978819

IUPAC5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one
SMILESO=C(c1c[nH]c(=O)cn1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C14H20N4O2/c19-13-8-16-12(7-17-13)14(20)18-6-2-3-10(9-18)11-4-1-5-15-11/h7-8,10-11,15H,1-6,9H2,(H,17,19)
InChIKeyBFKYFVGPESUKPB-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.37
Rot. Bonds2

About 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one

5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one (PubChem CID 60978819) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one.

Molecular Properties

Compound Name5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one
PubChem CID60978819
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one
SMILESO=C(c1c[nH]c(=O)cn1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C14H20N4O2/c19-13-8-16-12(7-17-13)14(20)18-6-2-3-10(9-18)11-4-1-5-15-11/h7-8,10-11,15H,1-6,9H2,(H,17,19)
InChIKeyBFKYFVGPESUKPB-UHFFFAOYSA-N
XLogP0.37
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-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

Frequently Asked Questions

What is the IUPAC name of 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one?
The IUPAC name of 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one (CID 60978819) is 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one.
What is the SMILES notation for 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one?
The canonical SMILES for 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one is O=C(c1c[nH]c(=O)cn1)N1CCCC(C2CCCN2)C1.
What is the InChIKey of 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one?
The InChIKey is BFKYFVGPESUKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c19-13-8-16-12(7-17-13)14(20)18-6-2-3-10(9-18)11-4-1-5-15-11/h7-8,10-11,15H,1-6,9H2,(H,17,19).
What are the key properties of 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one?
5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one has a molecular weight of 276.34 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrazin-2-one is sourced from PubChem (CID 60978819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).