1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole

C94H147N35O4S3 — CID 161176227

About 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole

1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole (PubChem CID 161176227) has the molecular formula C94H147N35O4S3 and a molecular weight of 1927.65 g/mol. Its IUPAC name is 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole.

Molecular Properties

• Compound Name: 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole
• PubChem CID: 161176227
• Molecular Formula: C94H147N35O4S3
• Molecular Weight: 1927.65 g/mol
• Exact Mass: 1926.15
• IUPAC Name: 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole
• SMILES: CC1=NC=NC1.CC1=NCC(C)=C1C.Cc1cc(C)cc(C)c1.Cc1cccc(C)n1.Cc1cccn1C.Cc1ccn(C)n1.Cc1cnc(C)s1.Cc1cnn(CC(C)(C)O)c1.Cc1csc(C)n1.Cc1n[nH]c(C)n1.Cc1nccn1C.Cc1nccs1.Cc1ncn(C)n1.Cc1ncnn1C.Cc1nnn(C)n1.Cc1nnn(CC(C)(C)O)n1.Cc1noc(C)n1.Cc1noc(C)n1
• InChI: InChI=1S/C9H12.C8H14N2O.C7H11N.C7H9N.C6H12N4O.C6H9N.2C5H8N2.2C5H7NS.3C4H7N3.2C4H6N2O.C4H6N2.C4H5NS.C3H6N4/c1-7-4-8(2)6-9(3)5-7;1-7-4-9-10(5-7)6-8(2,3)11;1-5-4-8-7(3)6(5)2;1-6-4-3-5-7(2)8-6;1-5-7-9-10(8-5)4-6(2,3)11;1-6-4-3-5-7(6)2;1-5-6-3-4-7(5)2;1-5-3-4-7(2)6-5;1-4-3-7-5(2)6-4;1-4-3-6-5(2)7-4;1-4-5-3-7(2)6-4;1-4-5-3-6-7(4)2;3*1-3-5-4(2)7-6-3;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-3-4-6-7(2)5-3/h4-6H,1-3H3;4-5,11H,6H2,1-3H3;4H2,1-3H3;3-5H,1-2H3;11H,4H2,1-3H3;3-5H,1-2H3;2*3-4H,1-2H3;4*3H,1-2H3;1-2H3,(H,5,6,7);2*1-2H3;3H,2H2,1H3;2-3H,1H3;1-2H3
• InChIKey: URVQRZIAZQYZTK-UHFFFAOYSA-N
• XLogP: 16.63
• TPSA: 455.52 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 41
• Rotatable Bonds: 4
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1927.65
LogP ≤ 5	16.63
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole?

The IUPAC name of 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole (CID 161176227) is 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole.

What is the SMILES notation for 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole?

The canonical SMILES for 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole is CC1=NC=NC1.CC1=NCC(C)=C1C.Cc1cc(C)cc(C)c1.Cc1cccc(C)n1.Cc1cccn1C.Cc1ccn(C)n1.Cc1cnc(C)s1.Cc1cnn(CC(C)(C)O)c1.Cc1csc(C)n1.Cc1n[nH]c(C)n1.Cc1nccn1C.Cc1nccs1.Cc1ncn(C)n1.Cc1ncnn1C.Cc1nnn(C)n1.Cc1nnn(CC(C)(C)O)n1.Cc1noc(C)n1.Cc1noc(C)n1.

What is the InChIKey of 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole?

The InChIKey is URVQRZIAZQYZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12.C8H14N2O.C7H11N.C7H9N.C6H12N4O.C6H9N.2C5H8N2.2C5H7NS.3C4H7N3.2C4H6N2O.C4H6N2.C4H5NS.C3H6N4/c1-7-4-8(2)6-9(3)5-7;1-7-4-9-10(5-7)6-8(2,3)11;1-5-4-8-7(3)6(5)2;1-6-4-3-5-7(2)8-6;1-5-7-9-10(8-5)4-6(2,3)11;1-6-4-3-5-7(6)2;1-5-6-3-4-7(5)2;1-5-3-4-7(2)6-5;1-4-3-7-5(2)6-4;1-4-3-6-5(2)7-4;1-4-5-3-7(2)6-4;1-4-5-3-6-7(4)2;3*1-3-5-4(2)7-6-3;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-3-4-6-7(2)5-3/h4-6H,1-3H3;4-5,11H,6H2,1-3H3;4H2,1-3H3;3-5H,1-2H3;11H,4H2,1-3H3;3-5H,1-2H3;2*3-4H,1-2H3;4*3H,1-2H3;1-2H3,(H,5,6,7);2*1-2H3;3H,2H2,1H3;2-3H,1H3;1-2H3.

What are the key properties of 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole?

1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole has a molecular weight of 1927.65 g/mol, XLogP of 16.63, 4 rotatable bonds, 3 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);1,3-dimethylpyrazole;2,6-dimethylpyridine;1,2-dimethylpyrrole;2,5-dimethyltetrazole;2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;1,5-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;5-methyl-4H-imidazole;2-methyl-1-(4-methylpyrazol-1-yl)propan-2-ol;2-methyl-1-(5-methyltetrazol-2-yl)propan-2-ol;2-methyl-1,3-thiazole;1,3,5-trimethylbenzene;3,4,5-trimethyl-2H-pyrrole is sourced from PubChem (CID 161176227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).