3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum

C20H17N4Pt-3 — CID 171055621

IUPAC3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum
SMILESCc1c[n-]c(-c2ccccn2)c1.Cc1cc(-c2[c-]cccc2)[n-]n1.[Pt]
InChIInChI=1S/C10H9N2.C10H8N2.Pt/c1-8-6-10(12-7-8)9-4-2-3-5-11-9;1-8-7-10(12-11-8)9-5-3-2-4-6-9;/h2-7H,1H3;2-5,7H,1H3;/q-1;-2;
InChIKeySFBMXDPMHLZYEW-UHFFFAOYSA-N
MW508.46 g/mol
LogP3.83
Rot. Bonds2

About 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum

3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum (PubChem CID 171055621) has the molecular formula C20H17N4Pt-3 and a molecular weight of 508.46 g/mol. Its IUPAC name is 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum.

Molecular Properties

Compound Name3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum
PubChem CID171055621
Molecular FormulaC20H17N4Pt-3
Molecular Weight508.46 g/mol
Exact Mass508.11
IUPAC Name3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum
SMILESCc1c[n-]c(-c2ccccn2)c1.Cc1cc(-c2[c-]cccc2)[n-]n1.[Pt]
InChIInChI=1S/C10H9N2.C10H8N2.Pt/c1-8-6-10(12-7-8)9-4-2-3-5-11-9;1-8-7-10(12-11-8)9-5-3-2-4-6-9;/h2-7H,1H3;2-5,7H,1H3;/q-1;-2;
InChIKeySFBMXDPMHLZYEW-UHFFFAOYSA-N
XLogP3.83
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500508.46
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(5-methylpyrazol-2-id-3-yl)pyridine;platinum;bis(yttrium)
CID 148900201
2-(5-methylpyrazol-2-id-3-yl)pyridine
CID 22090468
iridium(3+);tris(2-(5-methylpyrazol-2-id-3-yl)pyridine)
CID 159822553
iridium;2-(5-methylpyrazol-2-id-3-yl)pyridine
CID 20807299
benzene;ethane;2-(5-methylpyrazol-2-id-3-yl)pyridine;osmium
CID 158549694
bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane
CID 58788802
zinc;carbanide;2-(5-methylpyrazol-2-id-3-yl)pyridine
CID 156628337
3-methyl-5-phenylpyrazol-1-ide;5-phenyl-3-(trifluoromethyl)pyrazol-1-ide;platinum;bis(pyrazol-1-ide)
CID 159983991
diphenyl(phenylmethyl)phosphanium;iridium(3+);2-(5-methylpyrazol-2-id-3-yl)pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 58567852
iridium;tris(2-phenylpyridine)
CID 23386734
2-(5-methylpyrazol-2-id-3-yl)pyridine;pyridine-2-carboxylic acid;zinc
CID 58858981
bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
CID 54724512

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum?
The IUPAC name of 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum (CID 171055621) is 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum.
What is the SMILES notation for 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum?
The canonical SMILES for 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum is Cc1c[n-]c(-c2ccccn2)c1.Cc1cc(-c2[c-]cccc2)[n-]n1.[Pt].
What is the InChIKey of 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum?
The InChIKey is SFBMXDPMHLZYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N2.C10H8N2.Pt/c1-8-6-10(12-7-8)9-4-2-3-5-11-9;1-8-7-10(12-11-8)9-5-3-2-4-6-9;/h2-7H,1H3;2-5,7H,1H3;/q-1;-2;.
What are the key properties of 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum?
3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum has a molecular weight of 508.46 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenylpyrazol-1-ide;2-(4-methylpyrrol-1-id-2-yl)pyridine;platinum is sourced from PubChem (CID 171055621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).