4-(oxolan-2-yl)oxadiazole

C6H8N2O2 — CID 155756493

IUPAC4-(oxolan-2-yl)oxadiazole
SMILESc1onnc1C1CCCO1
InChIInChI=1S/C6H8N2O2/c1-2-6(9-3-1)5-4-10-8-7-5/h4,6H,1-3H2
InChIKeyGSXUGKDLWFGICT-UHFFFAOYSA-N
MW140.14 g/mol
LogP0.92
Rot. Bonds1

About 4-(oxolan-2-yl)oxadiazole

4-(oxolan-2-yl)oxadiazole (PubChem CID 155756493) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 4-(oxolan-2-yl)oxadiazole.

Molecular Properties

Compound Name4-(oxolan-2-yl)oxadiazole
PubChem CID155756493
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name4-(oxolan-2-yl)oxadiazole
SMILESc1onnc1C1CCCO1
InChIInChI=1S/C6H8N2O2/c1-2-6(9-3-1)5-4-10-8-7-5/h4,6H,1-3H2
InChIKeyGSXUGKDLWFGICT-UHFFFAOYSA-N
XLogP0.92
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2R)-oxolan-2-yl]pyridine-3-carboxamide
CID 135030167
4-chloro-2-(chloromethyl)-6-(oxolan-2-yl)pyrimidine
CID 102538380
4-[(2R)-oxolan-2-yl]-1,3-thiazol-2-amine
CID 86336609
2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile
CID 14024161
4-chloro-6-(oxan-2-yl)pyrimidine
CID 172993090
3-methoxy-6-(oxan-2-yl)pyridazine
CID 117105921
3-bromo-2-methyl-6-(oxolan-2-yl)pyridine
CID 172992725
4-(oxan-2-yl)-1,3-thiazole
CID 91346575
2-(difluoromethyl)-6-(oxolan-2-yl)pyridine
CID 152696540
4-bromo-6-(oxan-2-yl)pyridazin-3-amine
CID 117105823
5-chloro-3-(oxolan-2-yl)-1H-pyridazin-6-one
CID 117105684
2-(oxolan-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ol
CID 117156611

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-yl)oxadiazole?
The IUPAC name of 4-(oxolan-2-yl)oxadiazole (CID 155756493) is 4-(oxolan-2-yl)oxadiazole.
What is the SMILES notation for 4-(oxolan-2-yl)oxadiazole?
The canonical SMILES for 4-(oxolan-2-yl)oxadiazole is c1onnc1C1CCCO1.
What is the InChIKey of 4-(oxolan-2-yl)oxadiazole?
The InChIKey is GSXUGKDLWFGICT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c1-2-6(9-3-1)5-4-10-8-7-5/h4,6H,1-3H2.
What are the key properties of 4-(oxolan-2-yl)oxadiazole?
4-(oxolan-2-yl)oxadiazole has a molecular weight of 140.14 g/mol, XLogP of 0.92, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-yl)oxadiazole is sourced from PubChem (CID 155756493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).