7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride

C6H6ClN3O — CID 164523227

IUPAC7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride
SMILESCl.O=c1[nH]ccn2cncc12
InChIInChI=1S/C6H5N3O.ClH/c10-6-5-3-7-4-9(5)2-1-8-6;/h1-4H,(H,8,10);1H
InChIKeyLSSUOPCRELMJGN-UHFFFAOYSA-N
MW171.59 g/mol
LogP0.44
Rot. Bonds

About 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride

7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride (PubChem CID 164523227) has the molecular formula C6H6ClN3O and a molecular weight of 171.59 g/mol. Its IUPAC name is 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride.

Molecular Properties

Compound Name7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride
PubChem CID164523227
Molecular FormulaC6H6ClN3O
Molecular Weight171.59 g/mol
Exact Mass171.02
IUPAC Name7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride
SMILESCl.O=c1[nH]ccn2cncc12
InChIInChI=1S/C6H5N3O.ClH/c10-6-5-3-7-4-9(5)2-1-8-6;/h1-4H,(H,8,10);1H
InChIKeyLSSUOPCRELMJGN-UHFFFAOYSA-N
XLogP0.44
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.59
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride?
The IUPAC name of 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride (CID 164523227) is 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride.
What is the SMILES notation for 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride?
The canonical SMILES for 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride is Cl.O=c1[nH]ccn2cncc12.
What is the InChIKey of 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride?
The InChIKey is LSSUOPCRELMJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O.ClH/c10-6-5-3-7-4-9(5)2-1-8-6;/h1-4H,(H,8,10);1H.
What are the key properties of 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride?
7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride has a molecular weight of 171.59 g/mol, XLogP of 0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-imidazo[1,5-a]pyrazin-8-one;hydrochloride is sourced from PubChem (CID 164523227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).