2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol

C9H10N2O3 — CID 115079599

IUPAC2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESOCCc1noc(Cc2ccco2)n1
InChIInChI=1S/C9H10N2O3/c12-4-3-8-10-9(14-11-8)6-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2
InChIKeyDKURNFLVGUCWBR-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.79
Rot. Bonds4

About 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol

2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol (PubChem CID 115079599) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol
PubChem CID115079599
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESOCCc1noc(Cc2ccco2)n1
InChIInChI=1S/C9H10N2O3/c12-4-3-8-10-9(14-11-8)6-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2
InChIKeyDKURNFLVGUCWBR-UHFFFAOYSA-N
XLogP0.79
TPSA72.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]propan-1-amine
CID 115079621
2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]acetic acid
CID 115079625
2-[5-[(2-aminophenyl)methyl]-1,2,4-oxadiazol-3-yl]ethanol
CID 104827027
[3-(furan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 115004199
5-(chloromethyl)-3-(furan-2-ylmethyl)-1,2,4-oxadiazole
CID 71364887
5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-amine
CID 115004217
1-[5-[2-(furan-2-yl)ethyl]-1,2,4-oxadiazol-3-yl]-N-methylmethanamine
CID 62337738
2-[5-(2-hydroxyethyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 115076899
1-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 115004180
2-[5-[(2-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl]ethanol
CID 115078940
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]methanamine
CID 134018549
1-[5-[2-(furan-2-yl)ethyl]-1,2,4-oxadiazol-3-yl]butan-2-amine
CID 62647862

Frequently Asked Questions

What is the IUPAC name of 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol?
The IUPAC name of 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol (CID 115079599) is 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol.
What is the SMILES notation for 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol?
The canonical SMILES for 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol is OCCc1noc(Cc2ccco2)n1.
What is the InChIKey of 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol?
The InChIKey is DKURNFLVGUCWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c12-4-3-8-10-9(14-11-8)6-7-2-1-5-13-7/h1-2,5,12H,3-4,6H2.
What are the key properties of 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol?
2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol has a molecular weight of 194.19 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol is sourced from PubChem (CID 115079599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).