5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole

C11H16N2O — CID 65413474

IUPAC5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole
SMILESC=Cc1nc(C2CCC(CC)C2)no1
InChIInChI=1S/C11H16N2O/c1-3-8-5-6-9(7-8)11-12-10(4-2)14-13-11/h4,8-9H,2-3,5-7H2,1H3
InChIKeyCHYZGHKEPAIXHO-UHFFFAOYSA-N
MW192.26 g/mol
LogP3.01
Rot. Bonds3

About 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole

5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole (PubChem CID 65413474) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole
PubChem CID65413474
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole
SMILESC=Cc1nc(C2CCC(CC)C2)no1
InChIInChI=1S/C11H16N2O/c1-3-8-5-6-9(7-8)11-12-10(4-2)14-13-11/h4,8-9H,2-3,5-7H2,1H3
InChIKeyCHYZGHKEPAIXHO-UHFFFAOYSA-N
XLogP3.01
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-cyclopropyl-1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 112734867
3-(4,4-dimethylcyclohexyl)-5-ethenyl-1,2,4-oxadiazole
CID 65389570
5-(diethoxymethyl)-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole
CID 65403522
1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]-2,2-dimethylpropan-1-amine
CID 65415298
[1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]cyclopropyl]methanamine
CID 113312330
4-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-amine
CID 65414293
4-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]butan-1-ol
CID 79192880
1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 65404122
1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]-3-methylbutan-1-amine
CID 65414702
3-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]propanoic acid
CID 65406908
(1S)-1-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]-2-methylbutan-1-amine
CID 104900170
2-[3-(3-ethylcyclopentyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 65414302

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole?
The IUPAC name of 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole (CID 65413474) is 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole?
The canonical SMILES for 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole is C=Cc1nc(C2CCC(CC)C2)no1.
What is the InChIKey of 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole?
The InChIKey is CHYZGHKEPAIXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-8-5-6-9(7-8)11-12-10(4-2)14-13-11/h4,8-9H,2-3,5-7H2,1H3.
What are the key properties of 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole?
5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole has a molecular weight of 192.26 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole is sourced from PubChem (CID 65413474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).