[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)

C19H16N6OPt — CID 153419201

IUPAC[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)
SMILES[C-]#[N+]c1cc(-c2cccc(C(C)(C)C[N-]C(=O)c3ccccn3)n2)[n-]n1.[Pt+2]
InChIInChI=1S/C19H17N6O.Pt/c1-19(2,12-22-18(26)14-7-4-5-10-21-14)16-9-6-8-13(23-16)15-11-17(20-3)25-24-15;/h4-11H,12H2,1-2H3,(H-,22,23,24,25,26);/q-1;+2/p-1
InChIKeyNQBSFKJRHGCXMP-UHFFFAOYSA-M
MW539.46 g/mol
LogP3.54
Rot. Bonds5

About [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)

[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) (PubChem CID 153419201) has the molecular formula C19H16N6OPt and a molecular weight of 539.46 g/mol. Its IUPAC name is [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+).

Molecular Properties

Compound Name[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)
PubChem CID153419201
Molecular FormulaC19H16N6OPt
Molecular Weight539.46 g/mol
Exact Mass539.10
IUPAC Name[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)
SMILES[C-]#[N+]c1cc(-c2cccc(C(C)(C)C[N-]C(=O)c3ccccn3)n2)[n-]n1.[Pt+2]
InChIInChI=1S/C19H17N6O.Pt/c1-19(2,12-22-18(26)14-7-4-5-10-21-14)16-9-6-8-13(23-16)15-11-17(20-3)25-24-15;/h4-11H,12H2,1-2H3,(H-,22,23,24,25,26);/q-1;+2/p-1
InChIKeyNQBSFKJRHGCXMP-UHFFFAOYSA-M
XLogP3.54
TPSA88.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500539.46
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) with MolForge

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Related Compounds

N-[2-[6-(5-isocyano-1H-pyrazol-3-yl)-2-pyridinyl]-2-methylpropyl]pyridine-2-carboxamide
CID 153419202
2-(3-tert-butylpyrazol-1-id-5-yl)-6-[tris[6-(3-tert-butylpyrazol-1-id-5-yl)-2-pyridinyl]methyl]pyridine;bis(platinum(2+))
CID 58756122
trizinc;6-[2-[2-(6-carboxy-2-pyridinyl)phenyl]phenyl]pyridine-2-carboxylic acid;5-[6-[2-[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]phenyl]phenyl]-2-pyridinyl]pyrazol-1-ide-3-carbonitrile;2-pyrazol-2-id-3-yl-6-[2-[2-(6-pyrazol-2-id-3-yl-2-pyridinyl)phenyl]phenyl]pyridine;6-[2-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]phenyl]pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[2-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]phenyl]phenyl]pyridine;zinc
CID 160601447
2-(5-methylpyrazol-2-id-3-yl)pyridine;pyridine-2-carboxylic acid;zinc
CID 58858981
2-(3-tert-butylpyrazol-1-id-5-yl)-6-(5-pyridin-2-ylbenzo[b][1]benzosilol-5-yl)pyridine;carbazol-9-ide;platinum(2+)
CID 140804358
2-[4-tert-butyl-6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-methylpropanoic acid;platinum
CID 58620891
2-(3-tert-butylpyrazol-1-id-5-yl)pyridine;4-(3-tert-butylpyrazol-1-id-5-yl)pyrimidine;platinum(2+)
CID 140723069
(Z)-4-hydroxypent-3-en-2-one;iridium;[2-methyl-2-(6-phenyl-2-pyridinyl)propyl]-(pyridin-2-ylmethyl)azanide
CID 153419171
methyl-[2-methyl-2-[6-(2,3,4-trifluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-2-pyridinyl]propanoyl]azanide;platinum(2+)
CID 58004407
3-hydroxy-3-methyl-1-pyridin-2-ylbutan-1-one
CID 175849018
2-(5-methylpyrazol-2-id-3-yl)pyridine
CID 22090468
4-methyl-4-pyridin-2-ylpentanoic acid
CID 10655411

Frequently Asked Questions

What is the IUPAC name of [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)?
The IUPAC name of [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) (CID 153419201) is [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+).
What is the SMILES notation for [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)?
The canonical SMILES for [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) is [C-]#[N+]c1cc(-c2cccc(C(C)(C)C[N-]C(=O)c3ccccn3)n2)[n-]n1.[Pt+2].
What is the InChIKey of [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)?
The InChIKey is NQBSFKJRHGCXMP-UHFFFAOYSA-M. The full InChI is InChI=1S/C19H17N6O.Pt/c1-19(2,12-22-18(26)14-7-4-5-10-21-14)16-9-6-8-13(23-16)15-11-17(20-3)25-24-15;/h4-11H,12H2,1-2H3,(H-,22,23,24,25,26);/q-1;+2/p-1.
What are the key properties of [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+)?
[2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) has a molecular weight of 539.46 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[6-(3-isocyanopyrazol-1-id-5-yl)-2-pyridinyl]-2-methylpropyl]-(pyridine-2-carbonyl)azanide;platinum(2+) is sourced from PubChem (CID 153419201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).