bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide

C24H24I4N2Te — CID 139159619

IUPACbis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide
SMILESCN(C)c1cccc2cccc([Te+](I)c3cccc4cccc(N(C)C)c34)c12.I[I-]I
InChIInChI=1S/C24H24IN2Te.I3/c1-26(2)19-13-5-9-17-11-7-15-21(23(17)19)28(25)22-16-8-12-18-10-6-14-20(24(18)22)27(3)4;1-3-2/h5-16H,1-4H3;/q+1;-1
InChIKeyLLOZXOFCPRPTIK-UHFFFAOYSA-N
MW975.69 g/mol
LogP3.44
Rot. Bonds4

About bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide

bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide (PubChem CID 139159619) has the molecular formula C24H24I4N2Te and a molecular weight of 975.69 g/mol. Its IUPAC name is bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide.

Molecular Properties

Compound Namebis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide
PubChem CID139159619
Molecular FormulaC24H24I4N2Te
Molecular Weight975.69 g/mol
Exact Mass977.72
IUPAC Namebis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide
SMILESCN(C)c1cccc2cccc([Te+](I)c3cccc4cccc(N(C)C)c34)c12.I[I-]I
InChIInChI=1S/C24H24IN2Te.I3/c1-26(2)19-13-5-9-17-11-7-15-21(23(17)19)28(25)22-16-8-12-18-10-6-14-20(24(18)22)27(3)4;1-3-2/h5-16H,1-4H3;/q+1;-1
InChIKeyLLOZXOFCPRPTIK-UHFFFAOYSA-N
XLogP3.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500975.69
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide?
The IUPAC name of bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide (CID 139159619) is bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide.
What is the SMILES notation for bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide?
The canonical SMILES for bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide is CN(C)c1cccc2cccc([Te+](I)c3cccc4cccc(N(C)C)c34)c12.I[I-]I.
What is the InChIKey of bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide?
The InChIKey is LLOZXOFCPRPTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24IN2Te.I3/c1-26(2)19-13-5-9-17-11-7-15-21(23(17)19)28(25)22-16-8-12-18-10-6-14-20(24(18)22)27(3)4;1-3-2/h5-16H,1-4H3;/q+1;-1.
What are the key properties of bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide?
bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide has a molecular weight of 975.69 g/mol, XLogP of 3.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide is sourced from PubChem (CID 139159619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).