2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)

C52H41F3N6Pt — CID 58401636

About 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)

2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+) (PubChem CID 58401636) has the molecular formula C52H41F3N6Pt and a molecular weight of 1002.01 g/mol. Its IUPAC name is 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+).

Molecular Properties

• Compound Name: 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)
• PubChem CID: 58401636
• Molecular Formula: C52H41F3N6Pt
• Molecular Weight: 1002.01 g/mol
• Exact Mass: 1001.30
• IUPAC Name: 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)
• SMILES: CNCc1ccnc(-c2[c-]c(C(F)(F)F)ccc2-n2c3ccccc3c3ccccc32)c1.Cc1[c-]c(-c2cc(N(C)C)ccn2)c(-n2c3ccccc3c3ccccc32)cc1.[Pt+2]
• InChI: InChI=1S/C26H19F3N3.C26H22N3.Pt/c1-30-16-17-12-13-31-22(14-17)21-15-18(26(27,28)29)10-11-25(21)32-23-8-4-2-6-19(23)20-7-3-5-9-24(20)32;1-18-12-13-26(22(16-18)23-17-19(28(2)3)14-15-27-23)29-24-10-6-4-8-20(24)21-9-5-7-11-25(21)29;/h2-14,30H,16H2,1H3;4-15,17H,1-3H3;/q2*-1;+2
• InChIKey: ALLSPZLOFHZLGB-UHFFFAOYSA-N
• XLogP: 12.40
• TPSA: 50.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1002.01
LogP ≤ 5	12.40
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)?

The IUPAC name of 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+) (CID 58401636) is 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+).

What is the SMILES notation for 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)?

The canonical SMILES for 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+) is CNCc1ccnc(-c2[c-]c(C(F)(F)F)ccc2-n2c3ccccc3c3ccccc32)c1.Cc1[c-]c(-c2cc(N(C)C)ccn2)c(-n2c3ccccc3c3ccccc32)cc1.[Pt+2].

What is the InChIKey of 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)?

The InChIKey is ALLSPZLOFHZLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19F3N3.C26H22N3.Pt/c1-30-16-17-12-13-31-22(14-17)21-15-18(26(27,28)29)10-11-25(21)32-23-8-4-2-6-19(23)20-7-3-5-9-24(20)32;1-18-12-13-26(22(16-18)23-17-19(28(2)3)14-15-27-23)29-24-10-6-4-8-20(24)21-9-5-7-11-25(21)29;/h2-14,30H,16H2,1H3;4-15,17H,1-3H3;/q2*-1;+2.

What are the key properties of 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+)?

2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+) has a molecular weight of 1002.01 g/mol, XLogP of 12.40, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-carbazol-9-yl-5-methylbenzene-6-id-1-yl)-N,N-dimethylpyridin-4-amine;1-[2-[2-carbazol-9-yl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;platinum(2+) is sourced from PubChem (CID 58401636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).