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

C5H5N5O2 — CID 134896597

IUPAC3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine
SMILESCc1nc(-c2noc(N)n2)no1
InChIInChI=1S/C5H5N5O2/c1-2-7-3(9-11-2)4-8-5(6)12-10-4/h1H3,(H2,6,8,10)
InChIKeyMBPPYAUXGIVOFE-UHFFFAOYSA-N
MW167.13 g/mol
LogP0.01
Rot. Bonds1

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

3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine (PubChem CID 134896597) has the molecular formula C5H5N5O2 and a molecular weight of 167.13 g/mol. Its IUPAC name is 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Name3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine
PubChem CID134896597
Molecular FormulaC5H5N5O2
Molecular Weight167.13 g/mol
Exact Mass167.04
IUPAC Name3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine
SMILESCc1nc(-c2noc(N)n2)no1
InChIInChI=1S/C5H5N5O2/c1-2-7-3(9-11-2)4-8-5(6)12-10-4/h1H3,(H2,6,8,10)
InChIKeyMBPPYAUXGIVOFE-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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Related Compounds

5,5'-Dimethyl-3,3'-bi(1,2,4-oxadiazole)
CID 667911
3-(5-Amino-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine
CID 541851
[3,3'-Bi(1,2,4-oxadiazole)]-5,5'-dicarbonitrile
CID 132277259
Dimethyl-[[3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]imino]-lambda4-sulfane
CID 134995412
N-hydroxy-5-methyl-1,2,4-oxadiazole-3-carboximidamide
CID 537701
5,5'-Bis(azidomethyl)-3,3'-bi-1,2,4-oxadiazole
CID 15509055
N'-Hydroxy-5-methyl-1,2,4-oxadiazole-3-carboximidamide
CID 135537899
CID 136070992
CID 136070992
5-Methyl-1,2,4-oxadiazole-3-carboxamide
CID 13597567
3-(3-Methyl-1,2,4-oxadiazol-5-yl)-1,2,4-oxadiazol-5-amine
CID 57140379
5-Methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1,2,4-oxadiazole
CID 68230696
5-Methyl-1,2,4-oxadiazole-3-carboximidamide;hydrochloride
CID 135124493

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine (CID 134896597) is 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine is Cc1nc(-c2noc(N)n2)no1.
What is the InChIKey of 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine?
The InChIKey is MBPPYAUXGIVOFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5O2/c1-2-7-3(9-11-2)4-8-5(6)12-10-4/h1H3,(H2,6,8,10).
What are the key properties of 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine?
3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-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 3-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 134896597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).