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

C9H15N3O2 — CID 60774866

IUPAC[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1Cc1ncno1
InChIInChI=1S/C9H15N3O2/c13-6-8-3-1-2-4-12(8)5-9-10-7-11-14-9/h7-8,13H,1-6H2
InChIKeyHZXJTSBCLWPZEN-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.42
Rot. Bonds3

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

[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol (PubChem CID 60774866) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol
PubChem CID60774866
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1Cc1ncno1
InChIInChI=1S/C9H15N3O2/c13-6-8-3-1-2-4-12(8)5-9-10-7-11-14-9/h7-8,13H,1-6H2
InChIKeyHZXJTSBCLWPZEN-UHFFFAOYSA-N
XLogP0.42
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol (CID 60774866) is [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol is OCC1CCCCN1Cc1ncno1.
What is the InChIKey of [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol?
The InChIKey is HZXJTSBCLWPZEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c13-6-8-3-1-2-4-12(8)5-9-10-7-11-14-9/h7-8,13H,1-6H2.
What are the key properties of [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol?
[1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol has a molecular weight of 197.24 g/mol, XLogP of 0.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,2,4-oxadiazol-5-ylmethyl)piperidin-2-yl]methanol is sourced from PubChem (CID 60774866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).