2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole

C11H19N3O — CID 123223666

IUPAC2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole
SMILESCCc1nnc(C2CCC(C)CN2C)o1
InChIInChI=1S/C11H19N3O/c1-4-10-12-13-11(15-10)9-6-5-8(2)7-14(9)3/h8-9H,4-7H2,1-3H3
InChIKeyKKOUHZORNGQRNJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.03
Rot. Bonds2

About 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole

2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole (PubChem CID 123223666) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole
PubChem CID123223666
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole
SMILESCCc1nnc(C2CCC(C)CN2C)o1
InChIInChI=1S/C11H19N3O/c1-4-10-12-13-11(15-10)9-6-5-8(2)7-14(9)3/h8-9H,4-7H2,1-3H3
InChIKeyKKOUHZORNGQRNJ-UHFFFAOYSA-N
XLogP2.03
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole?
The IUPAC name of 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole (CID 123223666) is 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole is CCc1nnc(C2CCC(C)CN2C)o1.
What is the InChIKey of 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole?
The InChIKey is KKOUHZORNGQRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-10-12-13-11(15-10)9-6-5-8(2)7-14(9)3/h8-9H,4-7H2,1-3H3.
What are the key properties of 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole?
2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole has a molecular weight of 209.29 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,5-dimethylpiperidin-2-yl)-5-ethyl-1,3,4-oxadiazole is sourced from PubChem (CID 123223666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).