5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole

C10H15N3O — CID 14898790

IUPAC5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole
SMILESCCC1C=C(c2nc(C)no2)CNC1
InChIInChI=1S/C10H15N3O/c1-3-8-4-9(6-11-5-8)10-12-7(2)13-14-10/h4,8,11H,3,5-6H2,1-2H3
InChIKeyHSLLNQVKLPCINK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.39
Rot. Bonds2

About 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole

5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole (PubChem CID 14898790) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole
PubChem CID14898790
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole
SMILESCCC1C=C(c2nc(C)no2)CNC1
InChIInChI=1S/C10H15N3O/c1-3-8-4-9(6-11-5-8)10-12-7(2)13-14-10/h4,8,11H,3,5-6H2,1-2H3
InChIKeyHSLLNQVKLPCINK-UHFFFAOYSA-N
XLogP1.39
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3,4-dihydro-2H-pyran-5-yl)-3-methyl-1,2,4-oxadiazole
CID 131114238
5-(6-azabicyclo[3.2.1]oct-3-en-4-yl)-3-methyl-1,2,4-oxadiazole;hydrochloride
CID 21476657
3-methyl-5-(1H-1,2,4-triazol-5-yl)-1,2,4-oxadiazole
CID 131159756
3-methyl-5-(5-methylpyrazin-2-yl)-1,2,4-oxadiazole
CID 52903741
3-methyl-5-(1-piperidin-3-yl-1,2,4-triazol-3-yl)-1,2,4-oxadiazole;hydrochloride
CID 120833998
5-[4-(cyclopropylmethoxy)phenyl]-3-methyl-1,2,4-oxadiazole
CID 91283745
3-methyl-5-pyridin-4-yl-1,2,4-oxadiazole
CID 21025706
3-methyl-5-(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-1,2,4-oxadiazole
CID 128881282
3-(2-fluoroethyl)-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,2,4-oxadiazole
CID 14898774
5-[2-(2-ethylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
CID 106421703
5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 71564469
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-(3-methyl-1,2,4-oxadiazol-5-yl)benzamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole?
The IUPAC name of 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole (CID 14898790) is 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole?
The canonical SMILES for 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole is CCC1C=C(c2nc(C)no2)CNC1.
What is the InChIKey of 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole?
The InChIKey is HSLLNQVKLPCINK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-3-8-4-9(6-11-5-8)10-12-7(2)13-14-10/h4,8,11H,3,5-6H2,1-2H3.
What are the key properties of 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole?
5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole has a molecular weight of 193.25 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethyl-1,2,3,6-tetrahydropyridin-5-yl)-3-methyl-1,2,4-oxadiazole is sourced from PubChem (CID 14898790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).