2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol

C5H8N2O2 — CID 83528731

IUPAC2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol
SMILESCc1nnc(CCO)o1
InChIInChI=1S/C5H8N2O2/c1-4-6-7-5(9-4)2-3-8/h8H,2-3H2,1H3
InChIKeyNZRGMYXITFOSJS-UHFFFAOYSA-N
MW128.13 g/mol
LogP-0.09
Rot. Bonds2

About 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol

2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol (PubChem CID 83528731) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol
PubChem CID83528731
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC Name2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol
SMILESCc1nnc(CCO)o1
InChIInChI=1S/C5H8N2O2/c1-4-6-7-5(9-4)2-3-8/h8H,2-3H2,1H3
InChIKeyNZRGMYXITFOSJS-UHFFFAOYSA-N
XLogP-0.09
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol?
The IUPAC name of 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol (CID 83528731) is 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol.
What is the SMILES notation for 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol?
The canonical SMILES for 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol is Cc1nnc(CCO)o1.
What is the InChIKey of 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol?
The InChIKey is NZRGMYXITFOSJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2/c1-4-6-7-5(9-4)2-3-8/h8H,2-3H2,1H3.
What are the key properties of 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol?
2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol has a molecular weight of 128.13 g/mol, XLogP of -0.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanol is sourced from PubChem (CID 83528731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).