3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole

C7H8N2O2 — CID 10820747

IUPAC3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole
SMILESCC1N=C(c2ccco2)NO1
InChIInChI=1S/C7H8N2O2/c1-5-8-7(9-11-5)6-3-2-4-10-6/h2-5H,1H3,(H,8,9)
InChIKeyUYBMYBQVHQLWGY-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.91
Rot. Bonds1

About 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole

3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole (PubChem CID 10820747) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole
PubChem CID10820747
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole
SMILESCC1N=C(c2ccco2)NO1
InChIInChI=1S/C7H8N2O2/c1-5-8-7(9-11-5)6-3-2-4-10-6/h2-5H,1H3,(H,8,9)
InChIKeyUYBMYBQVHQLWGY-UHFFFAOYSA-N
XLogP0.91
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;2-(furan-2-yl)furan
CID 161366084
(3aR,6aR)-2,5-bis(furan-2-yl)-3a,6a-dihydro-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 27126590
5-(furan-2-yl)-2,3-dimethyl-2H-pyrrole
CID 89142714
5-amino-2-(furan-2-yl)-1H-pyrimidine-4,6-dione
CID 82171064
2-(furan-2-yl)-1,4-dihydropyrimidine
CID 129140568
[2-(furan-2-yl)pyrimidin-4-yl]-trimethylstannane
CID 168921538
5-bromo-2-(furan-2-yl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 66298546
2,3-bis(furan-2-yl)-6,7-dimethylquinoxaline
CID 5125983
2-(furan-2-yl)-1,3,5-triazine
CID 54453407
[2-(furan-2-yl)cyclopenta-2,4-dien-1-yl]-trimethylsilane
CID 175924863
5-(furan-2-yl)-N,N-dimethyl-1H-1,2,4-triazol-3-amine
CID 130005940
ethane;2-phenylfuran
CID 143157762

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole?
The IUPAC name of 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole (CID 10820747) is 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole.
What is the SMILES notation for 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole?
The canonical SMILES for 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole is CC1N=C(c2ccco2)NO1.
What is the InChIKey of 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole?
The InChIKey is UYBMYBQVHQLWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-5-8-7(9-11-5)6-3-2-4-10-6/h2-5H,1H3,(H,8,9).
What are the key properties of 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole?
3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole has a molecular weight of 152.15 g/mol, XLogP of 0.91, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole is sourced from PubChem (CID 10820747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).