2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one

C10H10N4O2 — CID 175998476

IUPAC2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one
SMILESCc1nnc(N2CCn3cccc3C2=O)o1
InChIInChI=1S/C10H10N4O2/c1-7-11-12-10(16-7)14-6-5-13-4-2-3-8(13)9(14)15/h2-4H,5-6H2,1H3
InChIKeyNLNIZZKPLHPNLS-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.84
Rot. Bonds1

About 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one

2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one (PubChem CID 175998476) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one.

Molecular Properties

Compound Name2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one
PubChem CID175998476
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one
SMILESCc1nnc(N2CCn3cccc3C2=O)o1
InChIInChI=1S/C10H10N4O2/c1-7-11-12-10(16-7)14-6-5-13-4-2-3-8(13)9(14)15/h2-4H,5-6H2,1H3
InChIKeyNLNIZZKPLHPNLS-UHFFFAOYSA-N
XLogP0.84
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one?
The IUPAC name of 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one (CID 175998476) is 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one.
What is the SMILES notation for 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one?
The canonical SMILES for 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one is Cc1nnc(N2CCn3cccc3C2=O)o1.
What is the InChIKey of 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one?
The InChIKey is NLNIZZKPLHPNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-7-11-12-10(16-7)14-6-5-13-4-2-3-8(13)9(14)15/h2-4H,5-6H2,1H3.
What are the key properties of 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one?
2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one has a molecular weight of 218.22 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,3,4-oxadiazol-2-yl)-3,4-dihydropyrrolo[1,2-a]pyrazin-1-one is sourced from PubChem (CID 175998476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).