oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)

C6H8NO2RbW — CID 59373551

IUPACoxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)
SMILESCCC[CH-]C(=O)[N-][C-]=O.[Rb+].[W+2]
InChIInChI=1S/C6H8NO2.Rb.W/c1-2-3-4-6(9)7-5-8;;/h4H,2-3H2,1H3;;/q-3;+1;+2
InChIKeyGEWDPQLBLCXIMW-UHFFFAOYSA-N
MW395.44 g/mol
LogP-2.04
Rot. Bonds4

About oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)

oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+) (PubChem CID 59373551) has the molecular formula C6H8NO2RbW and a molecular weight of 395.44 g/mol. Its IUPAC name is oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+).

Molecular Properties

Compound Nameoxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)
PubChem CID59373551
Molecular FormulaC6H8NO2RbW
Molecular Weight395.44 g/mol
Exact Mass394.92
IUPAC Nameoxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)
SMILESCCC[CH-]C(=O)[N-][C-]=O.[Rb+].[W+2]
InChIInChI=1S/C6H8NO2.Rb.W/c1-2-3-4-6(9)7-5-8;;/h4H,2-3H2,1H3;;/q-3;+1;+2
InChIKeyGEWDPQLBLCXIMW-UHFFFAOYSA-N
XLogP-2.04
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.44
LogP ≤ 5-2.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)?
The IUPAC name of oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+) (CID 59373551) is oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+).
What is the SMILES notation for oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)?
The canonical SMILES for oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+) is CCC[CH-]C(=O)[N-][C-]=O.[Rb+].[W+2].
What is the InChIKey of oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)?
The InChIKey is GEWDPQLBLCXIMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8NO2.Rb.W/c1-2-3-4-6(9)7-5-8;;/h4H,2-3H2,1H3;;/q-3;+1;+2.
What are the key properties of oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+)?
oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+) has a molecular weight of 395.44 g/mol, XLogP of -2.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxomethyl(pentanoyl)azanide;rubidium(1+);tungsten(2+) is sourced from PubChem (CID 59373551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).