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

C9H10N4O — CID 53017496

IUPAC2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole
SMILESCC(C)c1nnc(-c2cnccn2)o1
InChIInChI=1S/C9H10N4O/c1-6(2)8-12-13-9(14-8)7-5-10-3-4-11-7/h3-6H,1-2H3
InChIKeyGVSLDBWSCGAAJS-UHFFFAOYSA-N
MW190.21 g/mol
LogP1.65
Rot. Bonds2

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

2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole (PubChem CID 53017496) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole
PubChem CID53017496
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole
SMILESCC(C)c1nnc(-c2cnccn2)o1
InChIInChI=1S/C9H10N4O/c1-6(2)8-12-13-9(14-8)7-5-10-3-4-11-7/h3-6H,1-2H3
InChIKeyGVSLDBWSCGAAJS-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

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Related Compounds

6-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)pyridin-3-amine
CID 146552784
2-propan-2-yl-5-[4-(trifluoromethyl)-2-pyridinyl]-1,3,4-oxadiazole
CID 169163359
2-(5-methoxy-2-pyridinyl)-5-propan-2-yl-1,3,4-oxadiazole
CID 169162935
(2S)-N-methyl-N-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]-1-pyrazin-2-ylpropan-2-amine
CID 124754261
(2S)-2-[[(1S)-3-amino-3-oxo-1-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)propyl]carbamoylamino]-3-hydroxybutanoic acid
CID 122542131
2-propan-2-yl-5-[5-(trifluoromethoxy)-2-pyridinyl]-1,3,4-oxadiazole
CID 169162789
5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)pyrimidine-4,6-diamine
CID 141455459
(3S,4R)-1-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]-4-(pyrazin-2-ylmethyl)pyrrolidin-3-ol
CID 135090193
2-(2-bromo-4-pyridinyl)-5-propan-2-yl-1,3,4-oxadiazole
CID 146446478
tris(2-pyrazin-2-ylpyrazine);ruthenium(1+)
CID 138986841
2-(3,5-dibromophenyl)-5-propan-2-yl-1,3,4-oxadiazole
CID 104530677
5-bromo-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
CID 90273289

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole?
The IUPAC name of 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole (CID 53017496) is 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole is CC(C)c1nnc(-c2cnccn2)o1.
What is the InChIKey of 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole?
The InChIKey is GVSLDBWSCGAAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-6(2)8-12-13-9(14-8)7-5-10-3-4-11-7/h3-6H,1-2H3.
What are the key properties of 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole?
2-propan-2-yl-5-pyrazin-2-yl-1,3,4-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 2-propan-2-yl-5-pyrazin-2-yl-1,3,4-oxadiazole is sourced from PubChem (CID 53017496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).