5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole

C18H25N5O2 — CID 133474973

IUPAC5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole
SMILESCC(C)COc1cncc(N2CCC(c3noc(C4CC4)n3)CC2)n1
InChIInChI=1S/C18H25N5O2/c1-12(2)11-24-16-10-19-9-15(20-16)23-7-5-13(6-8-23)17-21-18(25-22-17)14-3-4-14/h9-10,12-14H,3-8,11H2,1-2H3
InChIKeyOSBXIFYNOPMQRO-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.16
Rot. Bonds6

About 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole

5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole (PubChem CID 133474973) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole
PubChem CID133474973
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC Name5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole
SMILESCC(C)COc1cncc(N2CCC(c3noc(C4CC4)n3)CC2)n1
InChIInChI=1S/C18H25N5O2/c1-12(2)11-24-16-10-19-9-15(20-16)23-7-5-13(6-8-23)17-21-18(25-22-17)14-3-4-14/h9-10,12-14H,3-8,11H2,1-2H3
InChIKeyOSBXIFYNOPMQRO-UHFFFAOYSA-N
XLogP3.16
TPSA77.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole with MolForge

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Related Compounds

(1-methylimidazol-2-yl)-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]methanol
CID 133395788
[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-phenylmethanone
CID 154862545
5-cyclopropyl-3-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-oxadiazole
CID 133475123
3-[[4-[6-(2-methylpropoxy)pyrazin-2-yl]piperazin-1-yl]methyl]-1,2-oxazole
CID 71857382
2-(4-bromopiperidin-1-yl)-6-ethoxypyrazine
CID 80674111
2-cyclopentyl-N-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]acetamide
CID 167844405
5-[(3R)-1-(6-ethoxypyrazin-2-yl)piperidin-3-yl]-3-methyl-1,2,4-oxadiazole
CID 97119091
5-cyclopropyl-3-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 133474987
3-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-N,N-dimethylpyrazin-2-amine
CID 133475838
2-[1-(6-ethoxypyrazin-2-yl)piperidin-4-yl]oxyethanamine
CID 82693310
5-[6-(2-methylpropoxy)pyrazin-2-yl]-5-azaspiro[2.4]heptan-7-ol
CID 139009395
5-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]pyridine-2-carbonitrile
CID 133475245

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole?
The IUPAC name of 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole (CID 133474973) is 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole.
What is the SMILES notation for 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole?
The canonical SMILES for 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole is CC(C)COc1cncc(N2CCC(c3noc(C4CC4)n3)CC2)n1.
What is the InChIKey of 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole?
The InChIKey is OSBXIFYNOPMQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-12(2)11-24-16-10-19-9-15(20-16)23-7-5-13(6-8-23)17-21-18(25-22-17)14-3-4-14/h9-10,12-14H,3-8,11H2,1-2H3.
What are the key properties of 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole?
5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole has a molecular weight of 343.43 g/mol, XLogP of 3.16, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-[1-[6-(2-methylpropoxy)pyrazin-2-yl]piperidin-4-yl]-1,2,4-oxadiazole is sourced from PubChem (CID 133474973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).