azane;oxadiazole

C2H5N3O — CID 19780339

IUPACazane;oxadiazole
SMILESN.c1conn1
InChIInChI=1S/C2H2N2O.H3N/c1-2-5-4-3-1;/h1-2H;1H3
InChIKeyZQHDWVAZCISBBV-UHFFFAOYSA-N
MW87.08 g/mol
LogP0.23
Rot. Bonds

About azane;oxadiazole

azane;oxadiazole (PubChem CID 19780339) has the molecular formula C2H5N3O and a molecular weight of 87.08 g/mol. Its IUPAC name is azane;oxadiazole.

Molecular Properties

Compound Nameazane;oxadiazole
PubChem CID19780339
Molecular FormulaC2H5N3O
Molecular Weight87.08 g/mol
Exact Mass87.04
IUPAC Nameazane;oxadiazole
SMILESN.c1conn1
InChIInChI=1S/C2H2N2O.H3N/c1-2-5-4-3-1;/h1-2H;1H3
InChIKeyZQHDWVAZCISBBV-UHFFFAOYSA-N
XLogP0.23
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.08
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of azane;oxadiazole?
The IUPAC name of azane;oxadiazole (CID 19780339) is azane;oxadiazole.
What is the SMILES notation for azane;oxadiazole?
The canonical SMILES for azane;oxadiazole is N.c1conn1.
What is the InChIKey of azane;oxadiazole?
The InChIKey is ZQHDWVAZCISBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N2O.H3N/c1-2-5-4-3-1;/h1-2H;1H3.
What are the key properties of azane;oxadiazole?
azane;oxadiazole has a molecular weight of 87.08 g/mol, XLogP of 0.23, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;oxadiazole is sourced from PubChem (CID 19780339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).