cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)

C14H30FGeN3Zr — CID 151954500

IUPACcyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)
SMILESCCC[NH-].CCC[NH-].CCC[NH-].F[GeH2][c-]1cccc1.[Zr+4]
InChIInChI=1S/C5H6FGe.3C3H8N.Zr/c6-7-5-3-1-2-4-5;3*1-2-3-4;/h1-4H,7H2;3*4H,2-3H2,1H3;/q4*-1;+4
InChIKeyTXIRPLPEWBHTMU-UHFFFAOYSA-N
MW423.25 g/mol
LogP4.43
Rot. Bonds4

About cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)

cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+) (PubChem CID 151954500) has the molecular formula C14H30FGeN3Zr and a molecular weight of 423.25 g/mol. Its IUPAC name is cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+).

Molecular Properties

Compound Namecyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)
PubChem CID151954500
Molecular FormulaC14H30FGeN3Zr
Molecular Weight423.25 g/mol
Exact Mass423.07
IUPAC Namecyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)
SMILESCCC[NH-].CCC[NH-].CCC[NH-].F[GeH2][c-]1cccc1.[Zr+4]
InChIInChI=1S/C5H6FGe.3C3H8N.Zr/c6-7-5-3-1-2-4-5;3*1-2-3-4;/h1-4H,7H2;3*4H,2-3H2,1H3;/q4*-1;+4
InChIKeyTXIRPLPEWBHTMU-UHFFFAOYSA-N
XLogP4.43
TPSA71.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.25
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)?
The IUPAC name of cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+) (CID 151954500) is cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+).
What is the SMILES notation for cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)?
The canonical SMILES for cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+) is CCC[NH-].CCC[NH-].CCC[NH-].F[GeH2][c-]1cccc1.[Zr+4].
What is the InChIKey of cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)?
The InChIKey is TXIRPLPEWBHTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FGe.3C3H8N.Zr/c6-7-5-3-1-2-4-5;3*1-2-3-4;/h1-4H,7H2;3*4H,2-3H2,1H3;/q4*-1;+4.
What are the key properties of cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+)?
cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+) has a molecular weight of 423.25 g/mol, XLogP of 4.43, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-2,4-dien-1-yl(fluoro)germane;propylazanide;zirconium(4+) is sourced from PubChem (CID 151954500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).