3H-pyrrol-5-ylmethylidenetungsten

C5H5NW — CID 58336541

IUPAC3H-pyrrol-5-ylmethylidenetungsten
SMILES[W]=CC1=CCC=N1
InChIInChI=1S/C5H5N.W/c1-5-3-2-4-6-5;/h1,3-4H,2H2;
InChIKeyWKIMXUQWJCDIKH-UHFFFAOYSA-N
MW262.94 g/mol
LogP0.69
Rot. Bonds1

About 3H-pyrrol-5-ylmethylidenetungsten

3H-pyrrol-5-ylmethylidenetungsten (PubChem CID 58336541) has the molecular formula C5H5NW and a molecular weight of 262.94 g/mol. Its IUPAC name is 3H-pyrrol-5-ylmethylidenetungsten.

Molecular Properties

Compound Name3H-pyrrol-5-ylmethylidenetungsten
PubChem CID58336541
Molecular FormulaC5H5NW
Molecular Weight262.94 g/mol
Exact Mass262.99
IUPAC Name3H-pyrrol-5-ylmethylidenetungsten
SMILES[W]=CC1=CCC=N1
InChIInChI=1S/C5H5N.W/c1-5-3-2-4-6-5;/h1,3-4H,2H2;
InChIKeyWKIMXUQWJCDIKH-UHFFFAOYSA-N
XLogP0.69
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.94
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3H-pyrrol-5-ylmethylidenetungsten?
The IUPAC name of 3H-pyrrol-5-ylmethylidenetungsten (CID 58336541) is 3H-pyrrol-5-ylmethylidenetungsten.
What is the SMILES notation for 3H-pyrrol-5-ylmethylidenetungsten?
The canonical SMILES for 3H-pyrrol-5-ylmethylidenetungsten is [W]=CC1=CCC=N1.
What is the InChIKey of 3H-pyrrol-5-ylmethylidenetungsten?
The InChIKey is WKIMXUQWJCDIKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.W/c1-5-3-2-4-6-5;/h1,3-4H,2H2;.
What are the key properties of 3H-pyrrol-5-ylmethylidenetungsten?
3H-pyrrol-5-ylmethylidenetungsten has a molecular weight of 262.94 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-pyrrol-5-ylmethylidenetungsten is sourced from PubChem (CID 58336541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).