3-morpholin-4-yl-1H-pyrazin-2-one

C8H11N3O2 — CID 86681229

IUPAC3-morpholin-4-yl-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1N1CCOCC1
InChIInChI=1S/C8H11N3O2/c12-8-7(9-1-2-10-8)11-3-5-13-6-4-11/h1-2H,3-6H2,(H,10,12)
InChIKeyRSLJDIGVUAWVAX-UHFFFAOYSA-N
MW181.19 g/mol
LogP-0.39
Rot. Bonds1

About 3-morpholin-4-yl-1H-pyrazin-2-one

3-morpholin-4-yl-1H-pyrazin-2-one (PubChem CID 86681229) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is 3-morpholin-4-yl-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-morpholin-4-yl-1H-pyrazin-2-one
PubChem CID86681229
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC Name3-morpholin-4-yl-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1N1CCOCC1
InChIInChI=1S/C8H11N3O2/c12-8-7(9-1-2-10-8)11-3-5-13-6-4-11/h1-2H,3-6H2,(H,10,12)
InChIKeyRSLJDIGVUAWVAX-UHFFFAOYSA-N
XLogP-0.39
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-morpholin-4-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

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-1H-pyrazin-2-one?
The IUPAC name of 3-morpholin-4-yl-1H-pyrazin-2-one (CID 86681229) is 3-morpholin-4-yl-1H-pyrazin-2-one.
What is the SMILES notation for 3-morpholin-4-yl-1H-pyrazin-2-one?
The canonical SMILES for 3-morpholin-4-yl-1H-pyrazin-2-one is O=c1[nH]ccnc1N1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-1H-pyrazin-2-one?
The InChIKey is RSLJDIGVUAWVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c12-8-7(9-1-2-10-8)11-3-5-13-6-4-11/h1-2H,3-6H2,(H,10,12).
What are the key properties of 3-morpholin-4-yl-1H-pyrazin-2-one?
3-morpholin-4-yl-1H-pyrazin-2-one has a molecular weight of 181.19 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-1H-pyrazin-2-one is sourced from PubChem (CID 86681229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).