[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol

C10H16N2O3 — CID 106825527

IUPAC[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol
SMILESOCC1CCC(OCc2ncon2)CC1
InChIInChI=1S/C10H16N2O3/c13-5-8-1-3-9(4-2-8)14-6-10-11-7-15-12-10/h7-9,13H,1-6H2
InChIKeyZZEMKEQAUYNHIA-UHFFFAOYSA-N
MW212.25 g/mol
LogP1.14
Rot. Bonds4

About [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol

[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol (PubChem CID 106825527) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol
PubChem CID106825527
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol
SMILESOCC1CCC(OCc2ncon2)CC1
InChIInChI=1S/C10H16N2O3/c13-5-8-1-3-9(4-2-8)14-6-10-11-7-15-12-10/h7-9,13H,1-6H2
InChIKeyZZEMKEQAUYNHIA-UHFFFAOYSA-N
XLogP1.14
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol?
The IUPAC name of [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol (CID 106825527) is [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol.
What is the SMILES notation for [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol?
The canonical SMILES for [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol is OCC1CCC(OCc2ncon2)CC1.
What is the InChIKey of [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol?
The InChIKey is ZZEMKEQAUYNHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-5-8-1-3-9(4-2-8)14-6-10-11-7-15-12-10/h7-9,13H,1-6H2.
What are the key properties of [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol?
[4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol has a molecular weight of 212.25 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexyl]methanol is sourced from PubChem (CID 106825527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).