5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole

C9H10N4O — CID 67986592

IUPAC5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESCC(C)c1nc(-c2cnccn2)no1
InChIInChI=1S/C9H10N4O/c1-6(2)9-12-8(13-14-9)7-5-10-3-4-11-7/h3-6H,1-2H3
InChIKeyVYLBORQDNKRUKK-UHFFFAOYSA-N
MW190.21 g/mol
LogP1.65
Rot. Bonds2

About 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole

5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole (PubChem CID 67986592) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole
PubChem CID67986592
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole
SMILESCC(C)c1nc(-c2cnccn2)no1
InChIInChI=1S/C9H10N4O/c1-6(2)9-12-8(13-14-9)7-5-10-3-4-11-7/h3-6H,1-2H3
InChIKeyVYLBORQDNKRUKK-UHFFFAOYSA-N
XLogP1.65
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole (CID 67986592) is 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole is CC(C)c1nc(-c2cnccn2)no1.
What is the InChIKey of 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole?
The InChIKey is VYLBORQDNKRUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-6(2)9-12-8(13-14-9)7-5-10-3-4-11-7/h3-6H,1-2H3.
What are the key properties of 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole?
5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole has a molecular weight of 190.21 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-3-pyrazin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 67986592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).