[2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide

C79H87N15OPt3 — CID 157070457

About [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide

[2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide (PubChem CID 157070457) has the molecular formula C79H87N15OPt3 and a molecular weight of 1847.90 g/mol. Its IUPAC name is [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide.

Molecular Properties

• Compound Name: [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide
• PubChem CID: 157070457
• Molecular Formula: C79H87N15OPt3
• Molecular Weight: 1847.90 g/mol
• Exact Mass: 1846.62
• IUPAC Name: [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide
• SMILES: CC(C)(C[N-]Cc1ccccn1)c1cccc(-c2[n-]nc3c2C2CCC3(C)C2(C)C)n1.CC12CCC(c3c1n[n-]c3-c1cccc(C(C[N-]Cc3ccccn3)c3ccccc3)n1)C2(C)C.CC12CCC(c3c1n[n-]c3-c1cccc(OC[N-]Cc3ccccn3)n1)C2(C)C.[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/C30H31N5.C26H31N5.C23H25N5O.3Pt/c1-29(2)23-15-16-30(29,3)28-26(23)27(34-35-28)25-14-9-13-24(33-25)22(20-10-5-4-6-11-20)19-31-18-21-12-7-8-17-32-21;1-24(2,16-27-15-17-9-6-7-14-28-17)20-11-8-10-19(29-20)22-21-18-12-13-26(5,25(18,3)4)23(21)31-30-22;1-22(2)16-10-11-23(22,3)21-19(16)20(27-28-21)17-8-6-9-18(26-17)29-14-24-13-15-7-4-5-12-25-15;;;/h4-14,17,22-23H,15-16,18-19H2,1-3H3;6-11,14,18H,12-13,15-16H2,1-5H3;4-9,12,16H,10-11,13-14H2,1-3H3;;;/q3*-2;3*+2
• InChIKey: ACJFKBNQCUNURL-UHFFFAOYSA-N
• XLogP: 16.47
• TPSA: 209.84 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 19
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1847.90
LogP ≤ 5	16.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide?

The IUPAC name of [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide (CID 157070457) is [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide.

What is the SMILES notation for [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide?

The canonical SMILES for [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide is CC(C)(C[N-]Cc1ccccn1)c1cccc(-c2[n-]nc3c2C2CCC3(C)C2(C)C)n1.CC12CCC(c3c1n[n-]c3-c1cccc(C(C[N-]Cc3ccccn3)c3ccccc3)n1)C2(C)C.CC12CCC(c3c1n[n-]c3-c1cccc(OC[N-]Cc3ccccn3)n1)C2(C)C.[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide?

The InChIKey is ACJFKBNQCUNURL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31N5.C26H31N5.C23H25N5O.3Pt/c1-29(2)23-15-16-30(29,3)28-26(23)27(34-35-28)25-14-9-13-24(33-25)22(20-10-5-4-6-11-20)19-31-18-21-12-7-8-17-32-21;1-24(2,16-27-15-17-9-6-7-14-28-17)20-11-8-10-19(29-20)22-21-18-12-13-26(5,25(18,3)4)23(21)31-30-22;1-22(2)16-10-11-23(22,3)21-19(16)20(27-28-21)17-8-6-9-18(26-17)29-14-24-13-15-7-4-5-12-25-15;;;/h4-14,17,22-23H,15-16,18-19H2,1-3H3;6-11,14,18H,12-13,15-16H2,1-5H3;4-9,12,16H,10-11,13-14H2,1-3H3;;;/q3*-2;3*+2.

What are the key properties of [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide?

[2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide has a molecular weight of 1847.90 g/mol, XLogP of 16.47, 19 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for [2-methyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]propyl]-(pyridin-2-ylmethyl)azanide;[2-phenyl-2-[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]ethyl]-(pyridin-2-ylmethyl)azanide;tris(platinum(2+));pyridin-2-ylmethyl-[[6-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)-2-pyridinyl]oxymethyl]azanide is sourced from PubChem (CID 157070457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).