2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)

C23H23F6N9O3Pt — CID 91971359

About 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)

2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+) (PubChem CID 91971359) has the molecular formula C23H23F6N9O3Pt and a molecular weight of 782.56 g/mol. Its IUPAC name is 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+).

Molecular Properties

• Compound Name: 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)
• PubChem CID: 91971359
• Molecular Formula: C23H23F6N9O3Pt
• Molecular Weight: 782.56 g/mol
• Exact Mass: 782.15
• IUPAC Name: 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)
• SMILES: COCCOCCOCCNc1ccncc1.FC(F)(F)c1n[n-]c(-c2cccc(-c3nc(C(F)(F)F)n[n-]3)n2)n1.[Pt+2]
• InChI: InChI=1S/C12H20N2O3.C11H3F6N7.Pt/c1-15-8-9-17-11-10-16-7-6-14-12-2-4-13-5-3-12;12-10(13,14)8-19-6(21-23-8)4-2-1-3-5(18-4)7-20-9(24-22-7)11(15,16)17;/h2-5H,6-11H2,1H3,(H,13,14);1-3H;/q;-2;+2
• InChIKey: XREXUCCEGQWZOI-UHFFFAOYSA-N
• XLogP: 3.12
• TPSA: 145.26 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 10
• Rotatable Bonds: 12
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	782.56
LogP ≤ 5	3.12
H-Bond Donors ≤ 5	1
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 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)?

The IUPAC name of 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+) (CID 91971359) is 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+).

What is the SMILES notation for 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)?

The canonical SMILES for 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+) is COCCOCCOCCNc1ccncc1.FC(F)(F)c1n[n-]c(-c2cccc(-c3nc(C(F)(F)F)n[n-]3)n2)n1.[Pt+2].

What is the InChIKey of 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)?

The InChIKey is XREXUCCEGQWZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3.C11H3F6N7.Pt/c1-15-8-9-17-11-10-16-7-6-14-12-2-4-13-5-3-12;12-10(13,14)8-19-6(21-23-8)4-2-1-3-5(18-4)7-20-9(24-22-7)11(15,16)17;/h2-5H,6-11H2,1H3,(H,13,14);1-3H;/q;-2;+2.

What are the key properties of 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+)?

2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+) has a molecular weight of 782.56 g/mol, XLogP of 3.12, 12 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-bis[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pyridin-4-amine;platinum(2+) is sourced from PubChem (CID 91971359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).