carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)

C5H8N2W — CID 54681562

IUPACcarbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)
SMILESCc1[c-]nc[nH]1.[CH3-].[W+2]
InChIInChI=1S/C4H5N2.CH3.W/c1-4-2-5-3-6-4;;/h3H,1H3,(H,5,6);1H3;/q2*-1;+2
InChIKeyMBXADUDXVCLTPU-UHFFFAOYSA-N
MW279.97 g/mol
LogP0.97
Rot. Bonds

About carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)

carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+) (PubChem CID 54681562) has the molecular formula C5H8N2W and a molecular weight of 279.97 g/mol. Its IUPAC name is carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)
PubChem CID54681562
Molecular FormulaC5H8N2W
Molecular Weight279.97 g/mol
Exact Mass280.02
IUPAC Namecarbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)
SMILESCc1[c-]nc[nH]1.[CH3-].[W+2]
InChIInChI=1S/C4H5N2.CH3.W/c1-4-2-5-3-6-4;;/h3H,1H3,(H,5,6);1H3;/q2*-1;+2
InChIKeyMBXADUDXVCLTPU-UHFFFAOYSA-N
XLogP0.97
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.97
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)?
The IUPAC name of carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+) (CID 54681562) is carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+).
What is the SMILES notation for carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)?
The canonical SMILES for carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+) is Cc1[c-]nc[nH]1.[CH3-].[W+2].
What is the InChIKey of carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)?
The InChIKey is MBXADUDXVCLTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N2.CH3.W/c1-4-2-5-3-6-4;;/h3H,1H3,(H,5,6);1H3;/q2*-1;+2.
What are the key properties of carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+)?
carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+) has a molecular weight of 279.97 g/mol, XLogP of 0.97, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;5-methyl-1,4-dihydroimidazol-4-ide;tungsten(2+) is sourced from PubChem (CID 54681562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).