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

C10H17N3O2 — CID 62020474

IUPAC2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1Cc1ncno1
InChIInChI=1S/C10H17N3O2/c14-6-4-9-3-1-2-5-13(9)7-10-11-8-12-15-10/h8-9,14H,1-7H2
InChIKeyIMDZHHHKDWJMDV-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.81
Rot. Bonds4

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

2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol (PubChem CID 62020474) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol
PubChem CID62020474
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1Cc1ncno1
InChIInChI=1S/C10H17N3O2/c14-6-4-9-3-1-2-5-13(9)7-10-11-8-12-15-10/h8-9,14H,1-7H2
InChIKeyIMDZHHHKDWJMDV-UHFFFAOYSA-N
XLogP0.81
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol (CID 62020474) is 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol is OCCC1CCCCN1Cc1ncno1.
What is the InChIKey of 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol?
The InChIKey is IMDZHHHKDWJMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c14-6-4-9-3-1-2-5-13(9)7-10-11-8-12-15-10/h8-9,14H,1-7H2.
What are the key properties of 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol?
2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol has a molecular weight of 211.26 g/mol, XLogP of 0.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]ethanol is sourced from PubChem (CID 62020474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).