carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)

C8H11N3OW — CID 171527238

IUPACcarbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)
SMILESCCNC(=O)c1cnc[c-]n1.[CH3-].[W+2]
InChIInChI=1S/C7H8N3O.CH3.W/c1-2-9-7(11)6-5-8-3-4-10-6;;/h3,5H,2H2,1H3,(H,9,11);1H3;/q2*-1;+2
InChIKeyLKKOFLSQBIVMNK-UHFFFAOYSA-N
MW349.04 g/mol
LogP0.47
Rot. Bonds2

About carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)

carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+) (PubChem CID 171527238) has the molecular formula C8H11N3OW and a molecular weight of 349.04 g/mol. Its IUPAC name is carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)
PubChem CID171527238
Molecular FormulaC8H11N3OW
Molecular Weight349.04 g/mol
Exact Mass349.04
IUPAC Namecarbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)
SMILESCCNC(=O)c1cnc[c-]n1.[CH3-].[W+2]
InChIInChI=1S/C7H8N3O.CH3.W/c1-2-9-7(11)6-5-8-3-4-10-6;;/h3,5H,2H2,1H3,(H,9,11);1H3;/q2*-1;+2
InChIKeyLKKOFLSQBIVMNK-UHFFFAOYSA-N
XLogP0.47
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.04
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)?
The IUPAC name of carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+) (CID 171527238) is carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+).
What is the SMILES notation for carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)?
The canonical SMILES for carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+) is CCNC(=O)c1cnc[c-]n1.[CH3-].[W+2].
What is the InChIKey of carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)?
The InChIKey is LKKOFLSQBIVMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3O.CH3.W/c1-2-9-7(11)6-5-8-3-4-10-6;;/h3,5H,2H2,1H3,(H,9,11);1H3;/q2*-1;+2.
What are the key properties of carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+)?
carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+) has a molecular weight of 349.04 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;N-ethyl-2H-pyrazin-2-ide-6-carboxamide;tungsten(2+) is sourced from PubChem (CID 171527238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).