azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate

C10H34Cl2N12O12Pt2-6 — CID 169428663

IUPACazanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate
SMILESCl[Pt+].Cl[Pt+].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[NH-]CCC[NH2+]CCCC[NH2+]CCC[NH-].[NH2-].[NH2-].[NH2-].[NH2-]
InChIInChI=1S/C10H24N4.2ClH.4NO3.4H2N.2Pt/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;;;4*2-1(3)4;;;;;;/h11-14H,1-10H2;2*1H;;;;;4*1H2;;/q-2;;;8*-1;2*+2
InChIKeyFFBNMAUZXNZCSU-UHFFFAOYSA-N
MW975.52 g/mol
LogP3.06
Rot. Bonds11

About azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate

azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate (PubChem CID 169428663) has the molecular formula C10H34Cl2N12O12Pt2-6 and a molecular weight of 975.52 g/mol. Its IUPAC name is azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate.

Molecular Properties

Compound Nameazanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate
PubChem CID169428663
Molecular FormulaC10H34Cl2N12O12Pt2-6
Molecular Weight975.52 g/mol
Exact Mass974.11
IUPAC Nameazanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate
SMILESCl[Pt+].Cl[Pt+].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[NH-]CCC[NH2+]CCCC[NH2+]CCC[NH-].[NH2-].[NH2-].[NH2-].[NH2-]
InChIInChI=1S/C10H24N4.2ClH.4NO3.4H2N.2Pt/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;;;4*2-1(3)4;;;;;;/h11-14H,1-10H2;2*1H;;;;;4*1H2;;/q-2;;;8*-1;2*+2
InChIKeyFFBNMAUZXNZCSU-UHFFFAOYSA-N
XLogP3.06
TPSA479.62 Ų
H-Bond Donors2
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500975.52
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Azanide;5-[4-(5-azanidylpentylazaniumyl)butylazaniumyl]pentylazanide;bis(chloroplatinum(1+));tetranitrate
CID 158047675
Azanide;6-[2-(6-azanidylhexylazaniumyl)ethylazaniumyl]hexylazanide;bis(chloroplatinum(1+));tetranitrate
CID 160093068
Azanide;3-(4-azanidylbutylazaniumyl)propylazanide;carbanide;bis(chloroplatinum(1+));trinitrate
CID 160429427
Azanide;3-(4-azanidylbutylazaniumyl)propylazanide;bis(chloroplatinum(1+));trinitrate
CID 169431831
3-Aminopropyl-[4-(3-aminopropylazaniumyl)butyl]azanium;azane;tetrakis(nitric acid);bis(platinum(2+));dichloride
CID 9811806
Azanide;3-(4-azanidylbutylamino)propylazanide;chloroplatinum;nitric acid;dinitrate
CID 9854189
4-Aminobutyl(3-aminopropyl)azanium;azane;tris(nitric acid);bis(platinum(2+));dichloride
CID 9940897
N'-[2-(6-aminohexylamino)ethyl]hexane-1,6-diamine;azane;bis(chloroplatinum(1+));bis(nitric acid);dinitrate
CID 11457441
6-Aminohexyl-[4-(6-aminohexylazaniumyl)butyl]azanium;azane;platinum;dichloride;tetranitrate
CID 11557138
6-Aminohexyl-[2-(6-aminohexylazaniumyl)ethyl]azanium;azane;bis(platinum(2+));dichloride;tetranitrate
CID 11607707

Frequently Asked Questions

What is the IUPAC name of azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate?
The IUPAC name of azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate (CID 169428663) is azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate.
What is the SMILES notation for azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate?
The canonical SMILES for azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate is Cl[Pt+].Cl[Pt+].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[NH-]CCC[NH2+]CCCC[NH2+]CCC[NH-].[NH2-].[NH2-].[NH2-].[NH2-].
What is the InChIKey of azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate?
The InChIKey is FFBNMAUZXNZCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N4.2ClH.4NO3.4H2N.2Pt/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;;;4*2-1(3)4;;;;;;/h11-14H,1-10H2;2*1H;;;;;4*1H2;;/q-2;;;8*-1;2*+2.
What are the key properties of azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate?
azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate has a molecular weight of 975.52 g/mol, XLogP of 3.06, 11 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;3-[4-(3-azanidylpropylazaniumyl)butylazaniumyl]propylazanide;bis(chloroplatinum(1+));tetranitrate is sourced from PubChem (CID 169428663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).