2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole

C11H15N5O — CID 86774818

IUPAC2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole
SMILESCc1nnc(C(C)N2CCn3ccnc3C2)o1
InChIInChI=1S/C11H15N5O/c1-8(11-14-13-9(2)17-11)16-6-5-15-4-3-12-10(15)7-16/h3-4,8H,5-7H2,1-2H3
InChIKeyGCSHMRUTNNWQOC-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.15
Rot. Bonds2

About 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole

2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole (PubChem CID 86774818) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole
PubChem CID86774818
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole
SMILESCc1nnc(C(C)N2CCn3ccnc3C2)o1
InChIInChI=1S/C11H15N5O/c1-8(11-14-13-9(2)17-11)16-6-5-15-4-3-12-10(15)7-16/h3-4,8H,5-7H2,1-2H3
InChIKeyGCSHMRUTNNWQOC-UHFFFAOYSA-N
XLogP1.15
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The IUPAC name of 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole (CID 86774818) is 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The canonical SMILES for 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole is Cc1nnc(C(C)N2CCn3ccnc3C2)o1.
What is the InChIKey of 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
The InChIKey is GCSHMRUTNNWQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8(11-14-13-9(2)17-11)16-6-5-15-4-3-12-10(15)7-16/h3-4,8H,5-7H2,1-2H3.
What are the key properties of 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole?
2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole has a molecular weight of 233.27 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]-5-methyl-1,3,4-oxadiazole is sourced from PubChem (CID 86774818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).