6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)

C33H26F6N6Pt — CID 59357077

IUPAC6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)
SMILES[H]/N=C(\C=[C-]/Nc1cccc(C(Cc2ccccc2)(Cc2ccccc2)c2cccc(N/[C-]=C\C(=N/[H])C(F)(F)F)n2)n1)C(F)(F)F.[Pt+2]
InChIInChI=1S/C33H26F6N6.Pt/c34-32(35,36)25(40)17-19-42-29-15-7-13-27(44-29)31(21-23-9-3-1-4-10-23,22-24-11-5-2-6-12-24)28-14-8-16-30(45-28)43-20-18-26(41)33(37,38)39;/h1-18,40-41H,21-22H2,(H,42,44)(H,43,45);/q-2;+2/b40-25+,41-26+;
InChIKeyVNLXRVHPUUJJIV-CHZVUFBVSA-N
MW815.68 g/mol
LogP7.87
Rot. Bonds12

About 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)

6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) (PubChem CID 59357077) has the molecular formula C33H26F6N6Pt and a molecular weight of 815.68 g/mol. Its IUPAC name is 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+).

Molecular Properties

Compound Name6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)
PubChem CID59357077
Molecular FormulaC33H26F6N6Pt
Molecular Weight815.68 g/mol
Exact Mass815.18
IUPAC Name6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)
SMILES[H]/N=C(\C=[C-]/Nc1cccc(C(Cc2ccccc2)(Cc2ccccc2)c2cccc(N/[C-]=C\C(=N/[H])C(F)(F)F)n2)n1)C(F)(F)F.[Pt+2]
InChIInChI=1S/C33H26F6N6.Pt/c34-32(35,36)25(40)17-19-42-29-15-7-13-27(44-29)31(21-23-9-3-1-4-10-23,22-24-11-5-2-6-12-24)28-14-8-16-30(45-28)43-20-18-26(41)33(37,38)39;/h1-18,40-41H,21-22H2,(H,42,44)(H,43,45);/q-2;+2/b40-25+,41-26+;
InChIKeyVNLXRVHPUUJJIV-CHZVUFBVSA-N
XLogP7.87
TPSA97.54 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500815.68
LogP ≤ 57.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) with MolForge

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Launch Full Analysis

Related Compounds

n-Phenethyl-4-(7-phenyl-3,4-dihydro-1,8-naphthyridin-1(2h)-yl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 11677248
2,6-difluoro-3-[4-fluoro-6-[2-[4-fluoro-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57603934
1-phenyl-3-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]isoquinoline;platinum(2+)
CID 57603983
2,6-difluoro-3-[4-fluoro-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57604023
2-(2,4-difluorobenzene-6-id-1-yl)-4-fluoro-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604032
2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604039
2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57604064
2-(3-isocyanobenzene-6-id-1-yl)-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604067
3-[2-[4-fluoro-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-1-phenylisoquinoline;platinum(2+)
CID 57604073
platinum(2+);2-[3-(trifluoromethyl)benzene-6-id-1-yl]-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine
CID 57604077
2-(2,4-difluorobenzene-6-id-1-yl)-4-fluoro-6-[2-[4-fluoro-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
CID 57604083
2-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-4-fluoro-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)
CID 57604088

Frequently Asked Questions

What is the IUPAC name of 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)?
The IUPAC name of 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) (CID 59357077) is 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+).
What is the SMILES notation for 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)?
The canonical SMILES for 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) is [H]/N=C(\C=[C-]/Nc1cccc(C(Cc2ccccc2)(Cc2ccccc2)c2cccc(N/[C-]=C\C(=N/[H])C(F)(F)F)n2)n1)C(F)(F)F.[Pt+2].
What is the InChIKey of 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)?
The InChIKey is VNLXRVHPUUJJIV-CHZVUFBVSA-N. The full InChI is InChI=1S/C33H26F6N6.Pt/c34-32(35,36)25(40)17-19-42-29-15-7-13-27(44-29)31(21-23-9-3-1-4-10-23,22-24-11-5-2-6-12-24)28-14-8-16-30(45-28)43-20-18-26(41)33(37,38)39;/h1-18,40-41H,21-22H2,(H,42,44)(H,43,45);/q-2;+2/b40-25+,41-26+;.
What are the key properties of 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+)?
6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) has a molecular weight of 815.68 g/mol, XLogP of 7.87, 12 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1,3-diphenyl-2-[6-[(4,4,4-trifluoro-3-iminobut-1-enyl)amino]-2-pyridinyl]propan-2-yl]-N-(4,4,4-trifluoro-3-iminobut-1-enyl)pyridin-2-amine;platinum(2+) is sourced from PubChem (CID 59357077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).