10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide

C17H12N4Pt — CID 58517492

IUPAC10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide
SMILES[C-]#N.[Pt+2].[c-]1cccc2ccn3ccnc3c12.c1ccncc1
InChIInChI=1S/C11H7N2.C5H5N.CN.Pt/c1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;1-2-4-6-5-3-1;1-2;/h1-3,5-8H;1-5H;;/q-1;;-1;+2
InChIKeyCHLBQTIJAQJTNC-UHFFFAOYSA-N
MW467.39 g/mol
LogP3.46
Rot. Bonds

About 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide

10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide (PubChem CID 58517492) has the molecular formula C17H12N4Pt and a molecular weight of 467.39 g/mol. Its IUPAC name is 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide.

Molecular Properties

Compound Name10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide
PubChem CID58517492
Molecular FormulaC17H12N4Pt
Molecular Weight467.39 g/mol
Exact Mass467.07
IUPAC Name10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide
SMILES[C-]#N.[Pt+2].[c-]1cccc2ccn3ccnc3c12.c1ccncc1
InChIInChI=1S/C11H7N2.C5H5N.CN.Pt/c1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;1-2-4-6-5-3-1;1-2;/h1-3,5-8H;1-5H;;/q-1;;-1;+2
InChIKeyCHLBQTIJAQJTNC-UHFFFAOYSA-N
XLogP3.46
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.39
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide with MolForge

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Related Compounds

10H-imidazo[2,1-a]isoquinolin-10-ide;iridium;2-(2H-naphthalen-2-id-1-yl)pyridine
CID 58517580
(Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one;10H-imidazo[2,1-a]isoquinolin-10-ide;platinum
CID 58517613
2-fluoro-5-pyridin-2-ylbenzene-4-ide-1-carbonitrile;10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58518113
CID 58517988
CID 58517988
2-[3-(10H-imidazo[2,1-a]isoquinolin-10-id-2-yl)propyl]-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58517648
bis(10H-imidazo[2,1-a]isoquinolin-10-ide);iridium;8-methyl-10H-imidazo[2,1-a]isoquinolin-4-ium-1,10-diide
CID 171043166
5-methyl-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum
CID 58518069
CID 58944019
CID 58944019
imidazo[1,2-a]pyridin-8-amine;hydrochloride
CID 118705200
beryllium bis(10H-benzo[h]quinolin-10-ide)
CID 156697230
bromobenzene;iridium;pyridine
CID 87645537
CID 58943949
CID 58943949

Frequently Asked Questions

What is the IUPAC name of 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide?
The IUPAC name of 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide (CID 58517492) is 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide.
What is the SMILES notation for 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide?
The canonical SMILES for 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide is [C-]#N.[Pt+2].[c-]1cccc2ccn3ccnc3c12.c1ccncc1.
What is the InChIKey of 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide?
The InChIKey is CHLBQTIJAQJTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N2.C5H5N.CN.Pt/c1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;1-2-4-6-5-3-1;1-2;/h1-3,5-8H;1-5H;;/q-1;;-1;+2.
What are the key properties of 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide?
10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide has a molecular weight of 467.39 g/mol, XLogP of 3.46, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+);pyridine;cyanide is sourced from PubChem (CID 58517492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).