dichloroplatinum;pentylazanide;dihydrate

C10H28Cl2N2O2Pt-2 — CID 155804892

IUPACdichloroplatinum;pentylazanide;dihydrate
SMILESCCCCC[NH-].CCCCC[NH-].Cl[Pt]Cl.O.O
InChIInChI=1S/2C5H12N.2ClH.2H2O.Pt/c2*1-2-3-4-5-6;;;;;/h2*6H,2-5H2,1H3;2*1H;2*1H2;/q2*-1;;;;;+2/p-2
InChIKeyBKDZDJAKEXSCIP-UHFFFAOYSA-L
MW474.33 g/mol
LogP4.18
Rot. Bonds6

About dichloroplatinum;pentylazanide;dihydrate

dichloroplatinum;pentylazanide;dihydrate (PubChem CID 155804892) has the molecular formula C10H28Cl2N2O2Pt-2 and a molecular weight of 474.33 g/mol. Its IUPAC name is dichloroplatinum;pentylazanide;dihydrate.

Molecular Properties

Compound Namedichloroplatinum;pentylazanide;dihydrate
PubChem CID155804892
Molecular FormulaC10H28Cl2N2O2Pt-2
Molecular Weight474.33 g/mol
Exact Mass473.12
IUPAC Namedichloroplatinum;pentylazanide;dihydrate
SMILESCCCCC[NH-].CCCCC[NH-].Cl[Pt]Cl.O.O
InChIInChI=1S/2C5H12N.2ClH.2H2O.Pt/c2*1-2-3-4-5-6;;;;;/h2*6H,2-5H2,1H3;2*1H;2*1H2;/q2*-1;;;;;+2/p-2
InChIKeyBKDZDJAKEXSCIP-UHFFFAOYSA-L
XLogP4.18
TPSA110.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.33
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloroplatinum;pentylazanide;dihydrate?
The IUPAC name of dichloroplatinum;pentylazanide;dihydrate (CID 155804892) is dichloroplatinum;pentylazanide;dihydrate.
What is the SMILES notation for dichloroplatinum;pentylazanide;dihydrate?
The canonical SMILES for dichloroplatinum;pentylazanide;dihydrate is CCCCC[NH-].CCCCC[NH-].Cl[Pt]Cl.O.O.
What is the InChIKey of dichloroplatinum;pentylazanide;dihydrate?
The InChIKey is BKDZDJAKEXSCIP-UHFFFAOYSA-L. The full InChI is InChI=1S/2C5H12N.2ClH.2H2O.Pt/c2*1-2-3-4-5-6;;;;;/h2*6H,2-5H2,1H3;2*1H;2*1H2;/q2*-1;;;;;+2/p-2.
What are the key properties of dichloroplatinum;pentylazanide;dihydrate?
dichloroplatinum;pentylazanide;dihydrate has a molecular weight of 474.33 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroplatinum;pentylazanide;dihydrate is sourced from PubChem (CID 155804892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).