5-(furan-2-ylmethyl)oxadiazole

C7H6N2O2 — CID 174840733

IUPAC5-(furan-2-ylmethyl)oxadiazole
SMILESc1coc(Cc2cnno2)c1
InChIInChI=1S/C7H6N2O2/c1-2-6(10-3-1)4-7-5-8-9-11-7/h1-3,5H,4H2
InChIKeyCNXMUBUVIUSGLD-UHFFFAOYSA-N
MW150.14 g/mol
LogP1.25
Rot. Bonds2

About 5-(furan-2-ylmethyl)oxadiazole

5-(furan-2-ylmethyl)oxadiazole (PubChem CID 174840733) has the molecular formula C7H6N2O2 and a molecular weight of 150.14 g/mol. Its IUPAC name is 5-(furan-2-ylmethyl)oxadiazole.

Molecular Properties

Compound Name5-(furan-2-ylmethyl)oxadiazole
PubChem CID174840733
Molecular FormulaC7H6N2O2
Molecular Weight150.14 g/mol
Exact Mass150.04
IUPAC Name5-(furan-2-ylmethyl)oxadiazole
SMILESc1coc(Cc2cnno2)c1
InChIInChI=1S/C7H6N2O2/c1-2-6(10-3-1)4-7-5-8-9-11-7/h1-3,5H,4H2
InChIKeyCNXMUBUVIUSGLD-UHFFFAOYSA-N
XLogP1.25
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-amine
CID 115004217
2-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 115079599
5-(furan-2-ylmethyl)-2,3-dimethylpyrazine
CID 12558437
1-[5-(furan-2-ylmethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 115004180
[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
2-bromo-5-(furan-2-ylmethyl)-1,3-thiazole
CID 117259797
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
5-(2-methylpropyl)oxadiazole
CID 69481380
2-(furan-2-ylmethyl)-1,3-oxazole-5-carboxylic acid
CID 82402388
2-[2-(furan-2-ylmethyl)-1,3-oxazol-5-yl]acetaldehyde
CID 115087564

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethyl)oxadiazole?
The IUPAC name of 5-(furan-2-ylmethyl)oxadiazole (CID 174840733) is 5-(furan-2-ylmethyl)oxadiazole.
What is the SMILES notation for 5-(furan-2-ylmethyl)oxadiazole?
The canonical SMILES for 5-(furan-2-ylmethyl)oxadiazole is c1coc(Cc2cnno2)c1.
What is the InChIKey of 5-(furan-2-ylmethyl)oxadiazole?
The InChIKey is CNXMUBUVIUSGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2/c1-2-6(10-3-1)4-7-5-8-9-11-7/h1-3,5H,4H2.
What are the key properties of 5-(furan-2-ylmethyl)oxadiazole?
5-(furan-2-ylmethyl)oxadiazole has a molecular weight of 150.14 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethyl)oxadiazole is sourced from PubChem (CID 174840733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).