azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide

C12H39Cl2N7Pt2-2 — CID 159930479

IUPACazanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide
SMILESCCC[NH2+]CCC[NH-].CC[NH2+]CCC[NH-].Cl[Pt+].Cl[Pt+].[CH3-].[NH2-].[NH2-].[NH2-]
InChIInChI=1S/C6H15N2.C5H13N2.CH3.2ClH.3H2N.2Pt/c1-2-5-8-6-3-4-7;1-2-7-5-3-4-6;;;;;;;;/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3;1H3;2*1H;3*1H2;;/q3*-1;;;3*-1;2*+2
InChIKeyXKQXGDMFRLTXFR-UHFFFAOYSA-N
MW742.55 g/mol
LogP4.39
Rot. Bonds9

About azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide

azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide (PubChem CID 159930479) has the molecular formula C12H39Cl2N7Pt2-2 and a molecular weight of 742.55 g/mol. Its IUPAC name is azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide.

Molecular Properties

Compound Nameazanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide
PubChem CID159930479
Molecular FormulaC12H39Cl2N7Pt2-2
Molecular Weight742.55 g/mol
Exact Mass741.20
IUPAC Nameazanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide
SMILESCCC[NH2+]CCC[NH-].CC[NH2+]CCC[NH-].Cl[Pt+].Cl[Pt+].[CH3-].[NH2-].[NH2-].[NH2-]
InChIInChI=1S/C6H15N2.C5H13N2.CH3.2ClH.3H2N.2Pt/c1-2-5-8-6-3-4-7;1-2-7-5-3-4-6;;;;;;;;/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3;1H3;2*1H;3*1H2;;/q3*-1;;;3*-1;2*+2
InChIKeyXKQXGDMFRLTXFR-UHFFFAOYSA-N
XLogP4.39
TPSA181.32 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500742.55
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dipropylazanium dichloride
CID 23338822
ethyl(tridecyl)azanium iodide
CID 88651524
dibutylazanium hexafluorophosphate
CID 23620950
beryllium hexylazanide
CID 139799741
butylazanide;nickel(2+)
CID 19849066
butylazanide;zirconium
CID 150135597
butylazanide;yttrium
CID 158455835
ethyl-[4-[4-[4-(ethylazaniumyl)butylazaniumyl]but-2-ynylazaniumyl]butyl]azanium tetrachloride
CID 10741171
didodecylazanium fluoride
CID 87135434
butyl(dodecyl)azanium
CID 91941247
ethyl-[4-[4-[[(Z)-4-[[(Z)-4-(ethylazaniumyl)but-2-enyl]azaniumyl]but-2-enyl]azaniumyl]butylazaniumyl]butyl]azanium pentachloride
CID 11800488
ethyl(propyl)azanium;methyl sulfate
CID 139650778

Frequently Asked Questions

What is the IUPAC name of azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide?
The IUPAC name of azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide (CID 159930479) is azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide.
What is the SMILES notation for azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide?
The canonical SMILES for azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide is CCC[NH2+]CCC[NH-].CC[NH2+]CCC[NH-].Cl[Pt+].Cl[Pt+].[CH3-].[NH2-].[NH2-].[NH2-].
What is the InChIKey of azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide?
The InChIKey is XKQXGDMFRLTXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N2.C5H13N2.CH3.2ClH.3H2N.2Pt/c1-2-5-8-6-3-4-7;1-2-7-5-3-4-6;;;;;;;;/h7-8H,2-6H2,1H3;6-7H,2-5H2,1H3;1H3;2*1H;3*1H2;;/q3*-1;;;3*-1;2*+2.
What are the key properties of azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide?
azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide has a molecular weight of 742.55 g/mol, XLogP of 4.39, 9 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;carbanide;bis(chloroplatinum(1+));3-(ethylazaniumyl)propylazanide;3-(propylazaniumyl)propylazanide is sourced from PubChem (CID 159930479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).