imidazol-1-ylmethylidenetungsten

C4H4N2W — CID 155786244

IUPACimidazol-1-ylmethylidenetungsten
SMILES[W]=Cn1ccnc1
InChIInChI=1S/C4H4N2.W/c1-6-3-2-5-4-6;/h1-4H;
InChIKeyQDRSRFYTIMOQHY-UHFFFAOYSA-N
MW263.93 g/mol
LogP0.04
Rot. Bonds1

About imidazol-1-ylmethylidenetungsten

imidazol-1-ylmethylidenetungsten (PubChem CID 155786244) has the molecular formula C4H4N2W and a molecular weight of 263.93 g/mol. Its IUPAC name is imidazol-1-ylmethylidenetungsten.

Molecular Properties

Compound Nameimidazol-1-ylmethylidenetungsten
PubChem CID155786244
Molecular FormulaC4H4N2W
Molecular Weight263.93 g/mol
Exact Mass263.99
IUPAC Nameimidazol-1-ylmethylidenetungsten
SMILES[W]=Cn1ccnc1
InChIInChI=1S/C4H4N2.W/c1-6-3-2-5-4-6;/h1-4H;
InChIKeyQDRSRFYTIMOQHY-UHFFFAOYSA-N
XLogP0.04
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.93
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-penta-1,4-dienylimidazole
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Frequently Asked Questions

What is the IUPAC name of imidazol-1-ylmethylidenetungsten?
The IUPAC name of imidazol-1-ylmethylidenetungsten (CID 155786244) is imidazol-1-ylmethylidenetungsten.
What is the SMILES notation for imidazol-1-ylmethylidenetungsten?
The canonical SMILES for imidazol-1-ylmethylidenetungsten is [W]=Cn1ccnc1.
What is the InChIKey of imidazol-1-ylmethylidenetungsten?
The InChIKey is QDRSRFYTIMOQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2.W/c1-6-3-2-5-4-6;/h1-4H;.
What are the key properties of imidazol-1-ylmethylidenetungsten?
imidazol-1-ylmethylidenetungsten has a molecular weight of 263.93 g/mol, XLogP of 0.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for imidazol-1-ylmethylidenetungsten is sourced from PubChem (CID 155786244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).