phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)

C25H20N4OPt — CID 59399250

IUPACphenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)
SMILESCC(C)(c1cccc(C(=O)[N-]c2ccccc2)n1)c1cccc(-c2[c-]ccnc2)n1.[Pt+2]
InChIInChI=1S/C25H21N4O.Pt/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19;/h3-8,10-17H,1-2H3,(H,27,30);/q-1;+2/p-1
InChIKeyFRMAPMGTAIHTFV-UHFFFAOYSA-M
MW587.54 g/mol
LogP5.51
Rot. Bonds5

About phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)

phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) (PubChem CID 59399250) has the molecular formula C25H20N4OPt and a molecular weight of 587.54 g/mol. Its IUPAC name is phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+).

Molecular Properties

Compound Namephenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)
PubChem CID59399250
Molecular FormulaC25H20N4OPt
Molecular Weight587.54 g/mol
Exact Mass587.13
IUPAC Namephenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)
SMILESCC(C)(c1cccc(C(=O)[N-]c2ccccc2)n1)c1cccc(-c2[c-]ccnc2)n1.[Pt+2]
InChIInChI=1S/C25H21N4O.Pt/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19;/h3-8,10-17H,1-2H3,(H,27,30);/q-1;+2/p-1
InChIKeyFRMAPMGTAIHTFV-UHFFFAOYSA-M
XLogP5.51
TPSA69.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500587.54
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) with MolForge

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Related Compounds

10-[(4-Methylpiperazin-1-yl)methyl]-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15,17,19-nonaen-14-one
CID 24949242
(6-Methyl-2-pyridinyl)-(1'-methylspiro[1,3-dihydroisoquinoline-4,4'-piperidine]-2-yl)methanone
CID 97504986
(5-benzyl-1-methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridin-2-yl)(4-phenylpiperazino)methanone
CID 53160687
7-(Dimethylamino)-2-(isoquinoline-1-carbonyl)-3-(2-methylpropyl)-octahydropyrrolo[1,2-A]pyrazin-4-one
CID 132431825
[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-4-(N-phenylanilino)-2-pyridinyl]propan-2-yl]-4-(N-phenylanilino)pyridine-2-carbonyl]-(trifluoromethyl)azanide;platinum(2+)
CID 58831105
[6-[2-[6-[2,4-Difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-methylazanide;platinum(2+)
CID 59342219
[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(2,2,2-trifluoroacetyl)azanide;platinum(2+)
CID 59399103
[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(trifluoromethylsulfonyl)azanide;platinum(2+)
CID 59399210
[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(trifluoromethyl)azanide;platinum(2+)
CID 59399395
[6-[2-[6-(2,4-Difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(trifluoromethyl)azanide;platinum(2+)
CID 59645762
(5-Ethylpyridin-2-yl)-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]methanone
CID 68174700
[(3R,3aR,7aS)-3-(4-fluorophenyl)-1-(pyridine-2-carbonyl)-3,3a,4,6,7,7a-hexahydro-2H-pyrrolo[3,2-c]pyridin-5-yl]-pyridin-2-ylmethanone
CID 92577098

Frequently Asked Questions

What is the IUPAC name of phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)?
The IUPAC name of phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) (CID 59399250) is phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+).
What is the SMILES notation for phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)?
The canonical SMILES for phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) is CC(C)(c1cccc(C(=O)[N-]c2ccccc2)n1)c1cccc(-c2[c-]ccnc2)n1.[Pt+2].
What is the InChIKey of phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)?
The InChIKey is FRMAPMGTAIHTFV-UHFFFAOYSA-M. The full InChI is InChI=1S/C25H21N4O.Pt/c1-25(2,22-14-6-12-20(28-22)18-9-8-16-26-17-18)23-15-7-13-21(29-23)24(30)27-19-10-4-3-5-11-19;/h3-8,10-17H,1-2H3,(H,27,30);/q-1;+2/p-1.
What are the key properties of phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+)?
phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) has a molecular weight of 587.54 g/mol, XLogP of 5.51, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]azanide;platinum(2+) is sourced from PubChem (CID 59399250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).