1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one

C10H15N3O — CID 59825851

IUPAC1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one
SMILESCC(C)(C)c1ncn2c1CNC(=O)C2
InChIInChI=1S/C10H15N3O/c1-10(2,3)9-7-4-11-8(14)5-13(7)6-12-9/h6H,4-5H2,1-3H3,(H,11,14)
InChIKeyDNKHJEFTIBGODR-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.81
Rot. Bonds

About 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one

1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one (PubChem CID 59825851) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one
PubChem CID59825851
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one
SMILESCC(C)(C)c1ncn2c1CNC(=O)C2
InChIInChI=1S/C10H15N3O/c1-10(2,3)9-7-4-11-8(14)5-13(7)6-12-9/h6H,4-5H2,1-3H3,(H,11,14)
InChIKeyDNKHJEFTIBGODR-UHFFFAOYSA-N
XLogP0.81
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one?
The IUPAC name of 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one (CID 59825851) is 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one is CC(C)(C)c1ncn2c1CNC(=O)C2.
What is the InChIKey of 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one?
The InChIKey is DNKHJEFTIBGODR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-10(2,3)9-7-4-11-8(14)5-13(7)6-12-9/h6H,4-5H2,1-3H3,(H,11,14).
What are the key properties of 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one?
1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one has a molecular weight of 193.25 g/mol, XLogP of 0.81, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-7,8-dihydro-5H-imidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 59825851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).