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

C9H10N2O3 — CID 102660767

IUPAC1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESCc1ccoc1-c1nc(C(C)O)no1
InChIInChI=1S/C9H10N2O3/c1-5-3-4-13-7(5)9-10-8(6(2)12)11-14-9/h3-4,6,12H,1-2H3
InChIKeyVFLQSXAZQXDISI-UHFFFAOYSA-N
MW194.19 g/mol
LogP1.69
Rot. Bonds2

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

1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol (PubChem CID 102660767) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol.

Molecular Properties

Compound Name1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol
PubChem CID102660767
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol
SMILESCc1ccoc1-c1nc(C(C)O)no1
InChIInChI=1S/C9H10N2O3/c1-5-3-4-13-7(5)9-10-8(6(2)12)11-14-9/h3-4,6,12H,1-2H3
InChIKeyVFLQSXAZQXDISI-UHFFFAOYSA-N
XLogP1.69
TPSA72.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 104633859
1-[5-(2,4-dimethylphenyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660575
1-(5-phenyl-1,2,4-oxadiazol-3-yl)ethanol
CID 75481811
1-[5-(4-bromo-3-methylphenyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660664
2-[3-(3-methylfuran-2-yl)-1,2,4-oxadiazol-5-yl]benzene-1,3-diol
CID 136813540
1-[5-(2-ethylphenyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660556
1-[5-(2-methyl-3-pyridinyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660795
N-methyl-2-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]acetamide
CID 71970429
1-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660763
1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanol
CID 75525832
4-[3-(1-hydroxyethyl)-1,2,4-oxadiazol-5-yl]benzonitrile
CID 102660571
1-[5-(2-methyl-5-nitrophenyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660638

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The IUPAC name of 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol (CID 102660767) is 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol.
What is the SMILES notation for 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The canonical SMILES for 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol is Cc1ccoc1-c1nc(C(C)O)no1.
What is the InChIKey of 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol?
The InChIKey is VFLQSXAZQXDISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-5-3-4-13-7(5)9-10-8(6(2)12)11-14-9/h3-4,6,12H,1-2H3.
What are the key properties of 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol?
1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol has a molecular weight of 194.19 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-methylfuran-2-yl)-1,2,4-oxadiazol-3-yl]ethanol is sourced from PubChem (CID 102660767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).