5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine

C5H5N5O2 — CID 13407490

IUPAC5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine
SMILESCc1nnc(-c2nnc(N)o2)o1
InChIInChI=1S/C5H5N5O2/c1-2-7-8-3(11-2)4-9-10-5(6)12-4/h1H3,(H2,6,10)
InChIKeyOXDSCEJEDJQDKK-UHFFFAOYSA-N
MW167.13 g/mol
LogP0.01
Rot. Bonds1

About 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine

5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine (PubChem CID 13407490) has the molecular formula C5H5N5O2 and a molecular weight of 167.13 g/mol. Its IUPAC name is 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine
PubChem CID13407490
Molecular FormulaC5H5N5O2
Molecular Weight167.13 g/mol
Exact Mass167.04
IUPAC Name5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine
SMILESCc1nnc(-c2nnc(N)o2)o1
InChIInChI=1S/C5H5N5O2/c1-2-7-8-3(11-2)4-9-10-5(6)12-4/h1H3,(H2,6,10)
InChIKeyOXDSCEJEDJQDKK-UHFFFAOYSA-N
XLogP0.01
TPSA103.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.13
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine (CID 13407490) is 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine is Cc1nnc(-c2nnc(N)o2)o1.
What is the InChIKey of 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine?
The InChIKey is OXDSCEJEDJQDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5O2/c1-2-7-8-3(11-2)4-9-10-5(6)12-4/h1H3,(H2,6,10).
What are the key properties of 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine?
5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine has a molecular weight of 167.13 g/mol, XLogP of 0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 13407490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).