2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol

C12H18N2O3 — CID 55201053

IUPAC2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol
SMILESOC1CCCC1c1nc(CC2CCCO2)no1
InChIInChI=1S/C12H18N2O3/c15-10-5-1-4-9(10)12-13-11(14-17-12)7-8-3-2-6-16-8/h8-10,15H,1-7H2
InChIKeyFNEZGTAZENRGTF-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.42
Rot. Bonds3

About 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol

2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol (PubChem CID 55201053) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol
PubChem CID55201053
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol
SMILESOC1CCCC1c1nc(CC2CCCO2)no1
InChIInChI=1S/C12H18N2O3/c15-10-5-1-4-9(10)12-13-11(14-17-12)7-8-3-2-6-16-8/h8-10,15H,1-7H2
InChIKeyFNEZGTAZENRGTF-UHFFFAOYSA-N
XLogP1.42
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol?
The IUPAC name of 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol (CID 55201053) is 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol.
What is the SMILES notation for 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol?
The canonical SMILES for 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol is OC1CCCC1c1nc(CC2CCCO2)no1.
What is the InChIKey of 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol?
The InChIKey is FNEZGTAZENRGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c15-10-5-1-4-9(10)12-13-11(14-17-12)7-8-3-2-6-16-8/h8-10,15H,1-7H2.
What are the key properties of 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol?
2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol has a molecular weight of 238.29 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(oxolan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-ol is sourced from PubChem (CID 55201053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).