2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one

C6H8N4O — CID 156595105

IUPAC2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one
SMILESNC1=CN2C=CNC(=O)C2N1
InChIInChI=1S/C6H8N4O/c7-4-3-10-2-1-8-6(11)5(10)9-4/h1-3,5,9H,7H2,(H,8,11)
InChIKeyCNQQEMIYGPYVNR-UHFFFAOYSA-N
MW152.16 g/mol
LogP-1.42
Rot. Bonds

About 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one

2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one (PubChem CID 156595105) has the molecular formula C6H8N4O and a molecular weight of 152.16 g/mol. Its IUPAC name is 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one
PubChem CID156595105
Molecular FormulaC6H8N4O
Molecular Weight152.16 g/mol
Exact Mass152.07
IUPAC Name2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one
SMILESNC1=CN2C=CNC(=O)C2N1
InChIInChI=1S/C6H8N4O/c7-4-3-10-2-1-8-6(11)5(10)9-4/h1-3,5,9H,7H2,(H,8,11)
InChIKeyCNQQEMIYGPYVNR-UHFFFAOYSA-N
XLogP-1.42
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-1.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one?
The IUPAC name of 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one (CID 156595105) is 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one.
What is the SMILES notation for 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one?
The canonical SMILES for 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one is NC1=CN2C=CNC(=O)C2N1.
What is the InChIKey of 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one?
The InChIKey is CNQQEMIYGPYVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O/c7-4-3-10-2-1-8-6(11)5(10)9-4/h1-3,5,9H,7H2,(H,8,11).
What are the key properties of 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one?
2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one has a molecular weight of 152.16 g/mol, XLogP of -1.42, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-7,8a-dihydro-1H-imidazo[1,2-a]pyrazin-8-one is sourced from PubChem (CID 156595105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).