2-aminoimidazo[1,5-a]pyrazin-3-one

C6H6N4O — CID 139392957

IUPAC2-aminoimidazo[1,5-a]pyrazin-3-one
SMILESNn1cc2cnccn2c1=O
InChIInChI=1S/C6H6N4O/c7-10-4-5-3-8-1-2-9(5)6(10)11/h1-4H,7H2
InChIKeyZHSWPWCHAATPEJ-UHFFFAOYSA-N
MW150.14 g/mol
LogP-0.79
Rot. Bonds

About 2-aminoimidazo[1,5-a]pyrazin-3-one

2-aminoimidazo[1,5-a]pyrazin-3-one (PubChem CID 139392957) has the molecular formula C6H6N4O and a molecular weight of 150.14 g/mol. Its IUPAC name is 2-aminoimidazo[1,5-a]pyrazin-3-one.

Molecular Properties

Compound Name2-aminoimidazo[1,5-a]pyrazin-3-one
PubChem CID139392957
Molecular FormulaC6H6N4O
Molecular Weight150.14 g/mol
Exact Mass150.05
IUPAC Name2-aminoimidazo[1,5-a]pyrazin-3-one
SMILESNn1cc2cnccn2c1=O
InChIInChI=1S/C6H6N4O/c7-10-4-5-3-8-1-2-9(5)6(10)11/h1-4H,7H2
InChIKeyZHSWPWCHAATPEJ-UHFFFAOYSA-N
XLogP-0.79
TPSA65.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-aminoimidazo[1,5-a]pyrazin-3-one?
The IUPAC name of 2-aminoimidazo[1,5-a]pyrazin-3-one (CID 139392957) is 2-aminoimidazo[1,5-a]pyrazin-3-one.
What is the SMILES notation for 2-aminoimidazo[1,5-a]pyrazin-3-one?
The canonical SMILES for 2-aminoimidazo[1,5-a]pyrazin-3-one is Nn1cc2cnccn2c1=O.
What is the InChIKey of 2-aminoimidazo[1,5-a]pyrazin-3-one?
The InChIKey is ZHSWPWCHAATPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O/c7-10-4-5-3-8-1-2-9(5)6(10)11/h1-4H,7H2.
What are the key properties of 2-aminoimidazo[1,5-a]pyrazin-3-one?
2-aminoimidazo[1,5-a]pyrazin-3-one has a molecular weight of 150.14 g/mol, XLogP of -0.79, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoimidazo[1,5-a]pyrazin-3-one is sourced from PubChem (CID 139392957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).