4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)

C53H85N35O5 — CID 157095307

About 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)

4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole) (PubChem CID 157095307) has the molecular formula C53H85N35O5 and a molecular weight of 1292.50 g/mol. Its IUPAC name is 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole).

Molecular Properties

• Compound Name: 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)
• PubChem CID: 157095307
• Molecular Formula: C53H85N35O5
• Molecular Weight: 1292.50 g/mol
• Exact Mass: 1291.75
• IUPAC Name: 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)
• SMILES: COc1cn[nH]c1C.COc1n[nH]nc1C.Cc1c(O)nnn1C.Cc1ccn[nH]1.Cc1cn[nH]c1C.Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1n[nH]nc1C.Cc1n[nH]nc1N.Cc1ncc[nH]1.Cc1ncco1.Cc1ncn[nH]1.Cc1ncn[nH]1.Cc1ncon1
• InChI: InChI=1S/C5H8N2O.C5H8N2.2C4H7N3O.C4H7N3.3C4H6N2.C4H5NO.C3H6N4.3C3H5N3.C3H4N2O/c1-4-5(8-2)3-6-7-4;1-4-3-6-7-5(4)2;1-3-4(8)5-6-7(3)2;1-3-4(8-2)6-7-5-3;1-3-4(2)6-7-5-3;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-5-6-4;1-4-5-2-3-6-4;1-2-3(4)6-7-5-2;2*1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-3-4-2-6-5-3/h3H,1-2H3,(H,6,7);3H,1-2H3,(H,6,7);8H,1-2H3;1-2H3,(H,5,6,7);1-2H3,(H,5,6,7);3*2-3H,1H3,(H,5,6);2-3H,1H3;1H3,(H3,4,5,6,7);3*2H,1H3,(H,4,5,6);2H,1H3
• InChIKey: AFDIRGHWNRXCQI-UHFFFAOYSA-N
• XLogP: 5.68
• TPSA: 553.19 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 29
• Rotatable Bonds: 2
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1292.50
LogP ≤ 5	5.68
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)?

The IUPAC name of 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole) (CID 157095307) is 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole).

What is the SMILES notation for 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)?

The canonical SMILES for 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole) is COc1cn[nH]c1C.COc1n[nH]nc1C.Cc1c(O)nnn1C.Cc1ccn[nH]1.Cc1cn[nH]c1C.Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1n[nH]nc1C.Cc1n[nH]nc1N.Cc1ncc[nH]1.Cc1ncco1.Cc1ncn[nH]1.Cc1ncn[nH]1.Cc1ncon1.

What is the InChIKey of 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)?

The InChIKey is AFDIRGHWNRXCQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O.C5H8N2.2C4H7N3O.C4H7N3.3C4H6N2.C4H5NO.C3H6N4.3C3H5N3.C3H4N2O/c1-4-5(8-2)3-6-7-4;1-4-3-6-7-5(4)2;1-3-4(8)5-6-7(3)2;1-3-4(8-2)6-7-5-3;1-3-4(2)6-7-5-3;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-5-6-4;1-4-5-2-3-6-4;1-2-3(4)6-7-5-2;2*1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-3-4-2-6-5-3/h3H,1-2H3,(H,6,7);3H,1-2H3,(H,6,7);8H,1-2H3;1-2H3,(H,5,6,7);1-2H3,(H,5,6,7);3*2-3H,1H3,(H,5,6);2-3H,1H3;1H3,(H3,4,5,6,7);3*2H,1H3,(H,4,5,6);2H,1H3.

What are the key properties of 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole)?

4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole) has a molecular weight of 1292.50 g/mol, XLogP of 5.68, 2 rotatable bonds, 13 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 4,5-dimethyl-1H-pyrazole;4,5-dimethyl-2H-triazole;1,5-dimethyltriazol-4-ol;4-methoxy-5-methyl-1H-pyrazole;4-methoxy-5-methyl-2H-triazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1H-pyrazole;5-methyl-2H-triazol-4-amine;4-methyl-2H-triazole;bis(5-methyl-1H-1,2,4-triazole) is sourced from PubChem (CID 157095307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).