ethane-1,2-diamine;platinum(4+);trinitrite;hydrate

C2H10N5O7Pt+ — CID 24738476

IUPACethane-1,2-diamine;platinum(4+);trinitrite;hydrate
SMILESNCCN.O.O=N[O-].O=N[O-].O=N[O-].[Pt+4]
InChIInChI=1S/C2H8N2.3HNO2.H2O.Pt/c3-1-2-4;3*2-1-3;;/h1-4H2;3*(H,2,3);1H2;/q;;;;;+4/p-3
InChIKeyJVFAJZFTGXJKKX-UHFFFAOYSA-K
MW411.21 g/mol
LogP-1.17
Rot. Bonds1

About ethane-1,2-diamine;platinum(4+);trinitrite;hydrate

ethane-1,2-diamine;platinum(4+);trinitrite;hydrate (PubChem CID 24738476) has the molecular formula C2H10N5O7Pt+ and a molecular weight of 411.21 g/mol. Its IUPAC name is ethane-1,2-diamine;platinum(4+);trinitrite;hydrate.

Molecular Properties

Compound Nameethane-1,2-diamine;platinum(4+);trinitrite;hydrate
PubChem CID24738476
Molecular FormulaC2H10N5O7Pt+
Molecular Weight411.21 g/mol
Exact Mass411.02
IUPAC Nameethane-1,2-diamine;platinum(4+);trinitrite;hydrate
SMILESNCCN.O.O=N[O-].O=N[O-].O=N[O-].[Pt+4]
InChIInChI=1S/C2H8N2.3HNO2.H2O.Pt/c3-1-2-4;3*2-1-3;;/h1-4H2;3*(H,2,3);1H2;/q;;;;;+4/p-3
InChIKeyJVFAJZFTGXJKKX-UHFFFAOYSA-K
XLogP-1.17
TPSA241.01 Ų
H-Bond Donors2
H-Bond Acceptors11
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.21
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

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Related Compounds

bis(ethane-1,2-diamine);palladium(2+);dinitrite
CID 119057726
cobalt;hydrazine;nitrite
CID 18779347
sodium;hydrazine;nitrite
CID 159617715
Sodium nitrite N-15
CID 23662135
neodymium(3+) trinitrite
CID 158721016
CID 19007947
CID 19007947
CID 20981982
CID 20981982
praseodymium(3+) trinitrite
CID 161020304
silver nitrite
CID 25199704
platinum(2+) dinitrite
CID 173066293
N'-[2-(3-aminopropylamino)ethyl]propane-1,3-diamine;cobalt;dinitrite
CID 6389182
copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate
CID 138319506

Frequently Asked Questions

What is the IUPAC name of ethane-1,2-diamine;platinum(4+);trinitrite;hydrate?
The IUPAC name of ethane-1,2-diamine;platinum(4+);trinitrite;hydrate (CID 24738476) is ethane-1,2-diamine;platinum(4+);trinitrite;hydrate.
What is the SMILES notation for ethane-1,2-diamine;platinum(4+);trinitrite;hydrate?
The canonical SMILES for ethane-1,2-diamine;platinum(4+);trinitrite;hydrate is NCCN.O.O=N[O-].O=N[O-].O=N[O-].[Pt+4].
What is the InChIKey of ethane-1,2-diamine;platinum(4+);trinitrite;hydrate?
The InChIKey is JVFAJZFTGXJKKX-UHFFFAOYSA-K. The full InChI is InChI=1S/C2H8N2.3HNO2.H2O.Pt/c3-1-2-4;3*2-1-3;;/h1-4H2;3*(H,2,3);1H2;/q;;;;;+4/p-3.
What are the key properties of ethane-1,2-diamine;platinum(4+);trinitrite;hydrate?
ethane-1,2-diamine;platinum(4+);trinitrite;hydrate has a molecular weight of 411.21 g/mol, XLogP of -1.17, 1 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diamine;platinum(4+);trinitrite;hydrate is sourced from PubChem (CID 24738476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).