2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol

C13H21N3O2 — CID 154743934

IUPAC2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol
SMILESOCCN1CCCCC1c1nnc(C2CCC2)o1
InChIInChI=1S/C13H21N3O2/c17-9-8-16-7-2-1-6-11(16)13-15-14-12(18-13)10-4-3-5-10/h10-11,17H,1-9H2
InChIKeyHJIFMLXUSONDAO-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.86
Rot. Bonds4

About 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol

2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol (PubChem CID 154743934) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol
PubChem CID154743934
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol
SMILESOCCN1CCCCC1c1nnc(C2CCC2)o1
InChIInChI=1S/C13H21N3O2/c17-9-8-16-7-2-1-6-11(16)13-15-14-12(18-13)10-4-3-5-10/h10-11,17H,1-9H2
InChIKeyHJIFMLXUSONDAO-UHFFFAOYSA-N
XLogP1.86
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclobutyl-5-[(2R)-1-(thiophen-3-ylmethyl)piperidin-2-yl]-1,3,4-oxadiazole
CID 129486644
2-[[(2R)-2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methyl]benzonitrile
CID 129486880
2-cyclobutyl-5-(1-ethylsulfonylpiperidin-2-yl)-1,3,4-oxadiazole
CID 128991904
2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 136542577
[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]-(1H-pyrrol-2-yl)methanone
CID 136543650
[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]-(2-hydroxy-4-propan-2-ylphenyl)methanone
CID 136544299
2-[(2R)-1-[(2S)-2-methyl-3-phenylpropyl]piperidin-2-yl]-5-(oxan-4-yl)-1,3,4-oxadiazole
CID 129478967
2-[(2S)-2-pyrazin-2-ylpiperidin-1-yl]ethanol
CID 95842061
2-[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanol
CID 95841214
(5-ethylfuran-2-yl)-[2-[5-(oxan-4-yl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 128990688
2-[2-[5-(hydroxymethyl)-1H-pyrazol-3-yl]piperidin-1-yl]ethanol
CID 110254159
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-[2-(hydroxymethyl)azepan-1-yl]acetamide
CID 116637804

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol?
The IUPAC name of 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol (CID 154743934) is 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol?
The canonical SMILES for 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol is OCCN1CCCCC1c1nnc(C2CCC2)o1.
What is the InChIKey of 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol?
The InChIKey is HJIFMLXUSONDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c17-9-8-16-7-2-1-6-11(16)13-15-14-12(18-13)10-4-3-5-10/h10-11,17H,1-9H2.
What are the key properties of 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol?
2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol has a molecular weight of 251.33 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]ethanol is sourced from PubChem (CID 154743934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).