5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole

C67H96N42O12S8 — CID 159604280

About 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole

5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole (PubChem CID 159604280) has the molecular formula C67H96N42O12S8 and a molecular weight of 1938.32 g/mol. Its IUPAC name is 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole.

Molecular Properties

• Compound Name: 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole
• PubChem CID: 159604280
• Molecular Formula: C67H96N42O12S8
• Molecular Weight: 1938.32 g/mol
• Exact Mass: 1936.60
• IUPAC Name: 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole
• SMILES: Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1cnco1.Cc1cncs1.Cc1cocn1.Cc1cscn1.Cc1n[nH]c(=O)[nH]1.Cc1n[nH]c(=O)o1.Cc1n[nH]c(=O)s1.Cc1n[nH]c(=S)o1.Cc1nc(=S)[nH][nH]1.Cc1nc(=S)o[nH]1.Cc1nc(N)n[nH]1.Cc1ncc[nH]1.Cc1ncco1.Cc1nccs1.Cc1ncn[nH]1.Cc1nn[nH]n1.Cc1noc(=O)[nH]1.Cc1nsc(=O)[nH]1
• InChI: InChI=1S/2C4H6N2.3C4H5NO.3C4H5NS.C3H6N4.C3H5N3O.C3H5N3S.2C3H5N3.2C3H4N2O2.4C3H4N2OS.C2H4N4/c1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-2-5-3(4)7-6-2;2*1-2-4-3(7)6-5-2;1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-2-4-5-3(6)7-2;1-2-4-3(6)7-5-2;1-2-4-5-3(6)7-2;1-2-4-5-3(7)6-2;1-2-4-3(6)7-5-2;1-2-4-3(7)6-5-2;1-2-3-5-6-4-2/h2*2-3H,1H3,(H,5,6);6*2-3H,1H3;1H3,(H3,4,5,6,7);2*1H3,(H2,4,5,6,7);2*2H,1H3,(H,4,5,6);1H3,(H,5,6);1H3,(H,4,5,6);1H3,(H,5,6);1H3,(H,5,7);1H3,(H,4,5,6);1H3,(H,4,5,7);1H3,(H,3,4,5,6)
• InChIKey: MLWJUIOZDUVTDB-UHFFFAOYSA-N
• XLogP: 10.06
• TPSA: 778.24 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 46
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1938.32
LogP ≤ 5	10.06
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole?

The IUPAC name of 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole (CID 159604280) is 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole.

What is the SMILES notation for 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole?

The canonical SMILES for 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole is Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1cnco1.Cc1cncs1.Cc1cocn1.Cc1cscn1.Cc1n[nH]c(=O)[nH]1.Cc1n[nH]c(=O)o1.Cc1n[nH]c(=O)s1.Cc1n[nH]c(=S)o1.Cc1nc(=S)[nH][nH]1.Cc1nc(=S)o[nH]1.Cc1nc(N)n[nH]1.Cc1ncc[nH]1.Cc1ncco1.Cc1nccs1.Cc1ncn[nH]1.Cc1nn[nH]n1.Cc1noc(=O)[nH]1.Cc1nsc(=O)[nH]1.

What is the InChIKey of 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole?

The InChIKey is MLWJUIOZDUVTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H6N2.3C4H5NO.3C4H5NS.C3H6N4.C3H5N3O.C3H5N3S.2C3H5N3.2C3H4N2O2.4C3H4N2OS.C2H4N4/c1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-2-5-3(4)7-6-2;2*1-2-4-3(7)6-5-2;1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-2-4-5-3(6)7-2;1-2-4-3(6)7-5-2;1-2-4-5-3(6)7-2;1-2-4-5-3(7)6-2;1-2-4-3(6)7-5-2;1-2-4-3(7)6-5-2;1-2-3-5-6-4-2/h2*2-3H,1H3,(H,5,6);6*2-3H,1H3;1H3,(H3,4,5,6,7);2*1H3,(H2,4,5,6,7);2*2H,1H3,(H,4,5,6);1H3,(H,5,6);1H3,(H,4,5,6);1H3,(H,5,6);1H3,(H,5,7);1H3,(H,4,5,6);1H3,(H,4,5,7);1H3,(H,3,4,5,6).

What are the key properties of 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole?

5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole has a molecular weight of 1938.32 g/mol, XLogP of 10.06, 0 rotatable bonds, 17 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 5-methyl-1,2-dihydro-1,2,4-triazole-3-thione;3-methyl-1,4-dihydro-1,2,4-triazol-5-one;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-2H-1,2,4-oxadiazole-5-thione;5-methyl-3H-1,3,4-oxadiazole-2-thione;3-methyl-4H-1,2,4-oxadiazol-5-one;5-methyl-3H-1,3,4-oxadiazol-2-one;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;5-methyl-1,3-oxazole;5-methyl-2H-tetrazole;3-methyl-4H-1,2,4-thiadiazol-5-one;5-methyl-3H-1,3,4-thiadiazol-2-one;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazol-3-amine;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole is sourced from PubChem (CID 159604280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).