1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole

C81H120F6N20 — CID 158182231

About 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole

1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole (PubChem CID 158182231) has the molecular formula C81H120F6N20 and a molecular weight of 1487.98 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole.

Molecular Properties

• Compound Name: 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole
• PubChem CID: 158182231
• Molecular Formula: C81H120F6N20
• Molecular Weight: 1487.98 g/mol
• Exact Mass: 1486.99
• IUPAC Name: 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole
• SMILES: Cc1cccnc1C.Cc1ccncc1C.Cc1cncnc1C.Cc1cnn(CC(F)(F)F)c1C.Cc1cnn(CC2CC2)c1C.Cc1nccnc1C.Cc1ncn(C(C)C)c1C.Cc1ncn(C)c1C.Cc1ncn(CC(C)C)c1C.Cc1ncn(CC(F)(F)F)c1C.Cc1ncn(CC2CC2)c1C
• InChI: InChI=1S/2C9H14N2.C9H16N2.C8H14N2.2C7H9F3N2.2C7H9N.C6H10N2.2C6H8N2/c1-7-8(2)11(6-10-7)5-9-3-4-9;1-7-5-10-11(8(7)2)6-9-3-4-9;1-7(2)5-11-6-10-8(3)9(11)4;1-6(2)10-5-9-7(3)8(10)4;1-5-6(2)12(4-11-5)3-7(8,9)10;1-5-3-11-12(6(5)2)4-7(8,9)10;1-6-3-4-8-5-7(6)2;1-6-4-3-5-8-7(6)2;1-5-6(2)8(3)4-7-5;1-5-3-7-4-8-6(5)2;1-5-6(2)8-4-3-7-5/h6,9H,3-5H2,1-2H3;5,9H,3-4,6H2,1-2H3;6-7H,5H2,1-4H3;5-6H,1-4H3;4H,3H2,1-2H3;3H,4H2,1-2H3;2*3-5H,1-2H3;4H,1-3H3;2*3-4H,1-2H3
• InChIKey: FYSRYHWUKIJAQJ-UHFFFAOYSA-N
• XLogP: 18.80
• TPSA: 202.08 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 9
• Heavy Atoms: 107
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1487.98
LogP ≤ 5	18.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole?

The IUPAC name of 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole (CID 158182231) is 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole.

What is the SMILES notation for 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole?

The canonical SMILES for 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole is Cc1cccnc1C.Cc1ccncc1C.Cc1cncnc1C.Cc1cnn(CC(F)(F)F)c1C.Cc1cnn(CC2CC2)c1C.Cc1nccnc1C.Cc1ncn(C(C)C)c1C.Cc1ncn(C)c1C.Cc1ncn(CC(C)C)c1C.Cc1ncn(CC(F)(F)F)c1C.Cc1ncn(CC2CC2)c1C.

What is the InChIKey of 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole?

The InChIKey is FYSRYHWUKIJAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H14N2.C9H16N2.C8H14N2.2C7H9F3N2.2C7H9N.C6H10N2.2C6H8N2/c1-7-8(2)11(6-10-7)5-9-3-4-9;1-7-5-10-11(8(7)2)6-9-3-4-9;1-7(2)5-11-6-10-8(3)9(11)4;1-6(2)10-5-9-7(3)8(10)4;1-5-6(2)12(4-11-5)3-7(8,9)10;1-5-3-11-12(6(5)2)4-7(8,9)10;1-6-3-4-8-5-7(6)2;1-6-4-3-5-8-7(6)2;1-5-6(2)8(3)4-7-5;1-5-3-7-4-8-6(5)2;1-5-6(2)8-4-3-7-5/h6,9H,3-5H2,1-2H3;5,9H,3-4,6H2,1-2H3;6-7H,5H2,1-4H3;5-6H,1-4H3;4H,3H2,1-2H3;3H,4H2,1-2H3;2*3-5H,1-2H3;4H,1-3H3;2*3-4H,1-2H3.

What are the key properties of 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole?

1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole has a molecular weight of 1487.98 g/mol, XLogP of 18.80, 9 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(cyclopropylmethyl)-4,5-dimethylimidazole;1-(cyclopropylmethyl)-4,5-dimethylpyrazole;4,5-dimethyl-1-(2-methylpropyl)imidazole;4,5-dimethyl-1-propan-2-ylimidazole;2,3-dimethylpyrazine;2,3-dimethylpyridine;3,4-dimethylpyridine;4,5-dimethylpyrimidine;4,5-dimethyl-1-(2,2,2-trifluoroethyl)imidazole;4,5-dimethyl-1-(2,2,2-trifluoroethyl)pyrazole;1,4,5-trimethylimidazole is sourced from PubChem (CID 158182231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).