3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)

C49H39F9N30Pt3 — CID 161480579

About 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)

3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine) (PubChem CID 161480579) has the molecular formula C49H39F9N30Pt3 and a molecular weight of 1804.28 g/mol. Its IUPAC name is 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine).

Molecular Properties

• Compound Name: 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)
• PubChem CID: 161480579
• Molecular Formula: C49H39F9N30Pt3
• Molecular Weight: 1804.28 g/mol
• Exact Mass: 1803.28
• IUPAC Name: 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)
• SMILES: Cc1n[n-]c(-c2nccn2-c2ccccc2)n1.Cc1n[n-]c(-c2nccn2C(C)C)n1.Cc1n[n-]c(-c2nccn2C)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/C12H10N5.C9H12N5.3C7H3F3N5.C7H8N5.3Pt/c1-9-14-11(16-15-9)12-13-7-8-17(12)10-5-3-2-4-6-10;1-6(2)14-5-4-10-9(14)8-11-7(3)12-13-8;3*8-7(9,10)6-13-5(14-15-6)4-3-11-1-2-12-4;1-5-9-6(11-10-5)7-8-3-4-12(7)2;;;/h2-8H,1H3;4-6H,1-3H3;3*1-3H;3-4H,1-2H3;;;/q6*-1;3*+2
• InChIKey: WEHMRWWKFYLFCV-UHFFFAOYSA-N
• XLogP: 5.65
• TPSA: 370.08 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 8
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1804.28
LogP ≤ 5	5.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)?

The IUPAC name of 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine) (CID 161480579) is 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine).

What is the SMILES notation for 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)?

The canonical SMILES for 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine) is Cc1n[n-]c(-c2nccn2-c2ccccc2)n1.Cc1n[n-]c(-c2nccn2C(C)C)n1.Cc1n[n-]c(-c2nccn2C)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.FC(F)(F)c1n[n-]c(-c2cnccn2)n1.[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)?

The InChIKey is WEHMRWWKFYLFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N5.C9H12N5.3C7H3F3N5.C7H8N5.3Pt/c1-9-14-11(16-15-9)12-13-7-8-17(12)10-5-3-2-4-6-10;1-6(2)14-5-4-10-9(14)8-11-7(3)12-13-8;3*8-7(9,10)6-13-5(14-15-6)4-3-11-1-2-12-4;1-5-9-6(11-10-5)7-8-3-4-12(7)2;;;/h2-8H,1H3;4-6H,1-3H3;3*1-3H;3-4H,1-2H3;;;/q6*-1;3*+2.

What are the key properties of 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine)?

3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine) has a molecular weight of 1804.28 g/mol, XLogP of 5.65, 8 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-5-(1-methylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-phenylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;3-methyl-5-(1-propan-2-ylimidazol-2-yl)-2,4-diaza-1-azanidacyclopenta-2,4-diene;tris(platinum(2+));tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyrazine) is sourced from PubChem (CID 161480579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).