3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole

C6H10N6O — CID 161430135

IUPAC3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole
SMILESCc1nn[nH]n1.Cc1noc(C)n1
InChIInChI=1S/C4H6N2O.C2H4N4/c1-3-5-4(2)7-6-3;1-2-3-5-6-4-2/h1-2H3;1H3,(H,3,4,5,6)
InChIKeyVXWZLYRHXNYGAS-UHFFFAOYSA-N
MW182.19 g/mol
LogP0.19
Rot. Bonds

About 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole

3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole (PubChem CID 161430135) has the molecular formula C6H10N6O and a molecular weight of 182.19 g/mol. Its IUPAC name is 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole.

Molecular Properties

Compound Name3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole
PubChem CID161430135
Molecular FormulaC6H10N6O
Molecular Weight182.19 g/mol
Exact Mass182.09
IUPAC Name3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole
SMILESCc1nn[nH]n1.Cc1noc(C)n1
InChIInChI=1S/C4H6N2O.C2H4N4/c1-3-5-4(2)7-6-3;1-2-3-5-6-4-2/h1-2H3;1H3,(H,3,4,5,6)
InChIKeyVXWZLYRHXNYGAS-UHFFFAOYSA-N
XLogP0.19
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,5-Dimethyl-N'-4H-1,2,4-triazol-4-yl-1,2,4-oxadiazole-3-carboximidamide
CID 5246608
3-tert-butyl-5-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 139497328
5-tert-butyl-3-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 139497374
5-methyl-3-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 142391598
3-methyl-5-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 142391681
CID 142469483
CID 142469483
5-propan-2-yl-3-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 146238792
3-propan-2-yl-5-(2H-tetrazol-5-yl)-1,2,4-oxadiazole
CID 147860722
3,5-Dimethyl-1,2,4-oxadiazole;2,5-dimethyltetrazole
CID 157241277
3,5-dimethyl-1,2,4-oxadiazole;methane;5-methyl-2H-tetrazole
CID 157610669
3,5-dimethyl-1,2,4-oxadiazole;methane;5-methyl-2H-tetrazole
CID 158096008
5-methyl-3-[2-(5-methyl-1H-1,2,4-triazol-3-yl)ethyl]-1,2,4-oxadiazole
CID 167249403

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole?
The IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole (CID 161430135) is 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole.
What is the SMILES notation for 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole?
The canonical SMILES for 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole is Cc1nn[nH]n1.Cc1noc(C)n1.
What is the InChIKey of 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole?
The InChIKey is VXWZLYRHXNYGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O.C2H4N4/c1-3-5-4(2)7-6-3;1-2-3-5-6-4-2/h1-2H3;1H3,(H,3,4,5,6).
What are the key properties of 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole?
3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole has a molecular weight of 182.19 g/mol, XLogP of 0.19, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1,2,4-oxadiazole;5-methyl-2H-tetrazole is sourced from PubChem (CID 161430135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).