3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one

C6H9N3O — CID 68819989

IUPAC3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one
SMILESO=C1CN2CCNC=C2N1
InChIInChI=1S/C6H9N3O/c10-6-4-9-2-1-7-3-5(9)8-6/h3,7H,1-2,4H2,(H,8,10)
InChIKeyJGPDEQCJMMJLLA-UHFFFAOYSA-N
MW139.16 g/mol
LogP-1.18
Rot. Bonds

About 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one

3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one (PubChem CID 68819989) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one.

Molecular Properties

Compound Name3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one
PubChem CID68819989
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one
SMILESO=C1CN2CCNC=C2N1
InChIInChI=1S/C6H9N3O/c10-6-4-9-2-1-7-3-5(9)8-6/h3,7H,1-2,4H2,(H,8,10)
InChIKeyJGPDEQCJMMJLLA-UHFFFAOYSA-N
XLogP-1.18
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one?
The IUPAC name of 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one (CID 68819989) is 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one.
What is the SMILES notation for 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one?
The canonical SMILES for 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one is O=C1CN2CCNC=C2N1.
What is the InChIKey of 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one?
The InChIKey is JGPDEQCJMMJLLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c10-6-4-9-2-1-7-3-5(9)8-6/h3,7H,1-2,4H2,(H,8,10).
What are the key properties of 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one?
3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one has a molecular weight of 139.16 g/mol, XLogP of -1.18, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,6,7-tetrahydro-1H-imidazo[1,2-a]pyrazin-2-one is sourced from PubChem (CID 68819989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).