azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)

C9H24N3O8PPt — CID 160828936

About azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)

azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+) (PubChem CID 160828936) has the molecular formula C9H24N3O8PPt and a molecular weight of 528.36 g/mol. Its IUPAC name is azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+).

Molecular Properties

• Compound Name: azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)
• PubChem CID: 160828936
• Molecular Formula: C9H24N3O8PPt
• Molecular Weight: 528.36 g/mol
• Exact Mass: 528.09
• IUPAC Name: azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)
• SMILES: CN(C)CCCC(CC(=O)O)C(=O)O.O=[P+]([O-])OO.[H][H].[NH2-].[NH2-].[Pt+2]
• InChI: InChI=1S/C9H17NO4.2H2N.HO4P.Pt.H2/c1-10(2)5-3-4-7(9(13)14)6-8(11)12;;;1-4-5(2)3;;/h7H,3-6H2,1-2H3,(H,11,12)(H,13,14);2*1H2;1H;;1H/q;2*-1;;+2
• InChIKey: QHYWEGDZDFRCOM-UHFFFAOYSA-N
• XLogP: 1.68
• TPSA: 214.43 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 8
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	528.36
LogP ≤ 5	1.68
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)?

The IUPAC name of azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+) (CID 160828936) is azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+).

What is the SMILES notation for azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)?

The canonical SMILES for azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+) is CN(C)CCCC(CC(=O)O)C(=O)O.O=[P+]([O-])OO.[H][H].[NH2-].[NH2-].[Pt+2].

What is the InChIKey of azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)?

The InChIKey is QHYWEGDZDFRCOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO4.2H2N.HO4P.Pt.H2/c1-10(2)5-3-4-7(9(13)14)6-8(11)12;;;1-4-5(2)3;;/h7H,3-6H2,1-2H3,(H,11,12)(H,13,14);2*1H2;1H;;1H/q;2*-1;;+2;.

What are the key properties of azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+)?

azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+) has a molecular weight of 528.36 g/mol, XLogP of 1.68, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for azanide;2-[3-(dimethylamino)propyl]butanedioic acid;hydroperoxy-oxido-oxophosphanium;molecular hydrogen;platinum(2+) is sourced from PubChem (CID 160828936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).