About amino-tris(dimethylamino)phosphanium
amino-tris(dimethylamino)phosphanium (PubChem CID 3090755) has the molecular formula C6H20N4P+
and a molecular weight of 179.23 g/mol. Its IUPAC name is amino-tris(dimethylamino)phosphanium.
Molecular Properties
| Compound Name | amino-tris(dimethylamino)phosphanium |
| PubChem CID | 3090755 |
| Molecular Formula | C6H20N4P+ |
| Molecular Weight | 179.23 g/mol |
| Exact Mass | 179.14 |
| IUPAC Name | amino-tris(dimethylamino)phosphanium |
| SMILES | CN(C)[P+](N)(N(C)C)N(C)C |
| InChI | InChI=1S/C6H20N4P/c1-8(2)11(7,9(3)4)10(5)6/h7H2,1-6H3/q+1 |
| InChIKey | VUNXYGBWNPJYDP-UHFFFAOYSA-N |
| XLogP | 0.31 |
| TPSA | 35.74 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 179.23 |
| LogP ≤ 5 | 0.31 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
|---|
Analyze amino-tris(dimethylamino)phosphanium with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of amino-tris(dimethylamino)phosphanium?
The IUPAC name of amino-tris(dimethylamino)phosphanium (CID 3090755) is amino-tris(dimethylamino)phosphanium.
What is the SMILES notation for amino-tris(dimethylamino)phosphanium?
The canonical SMILES for amino-tris(dimethylamino)phosphanium is CN(C)[P+](N)(N(C)C)N(C)C.
What is the InChIKey of amino-tris(dimethylamino)phosphanium?
The InChIKey is VUNXYGBWNPJYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H20N4P/c1-8(2)11(7,9(3)4)10(5)6/h7H2,1-6H3/q+1.
What are the key properties of amino-tris(dimethylamino)phosphanium?
amino-tris(dimethylamino)phosphanium has a molecular weight of 179.23 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for amino-tris(dimethylamino)phosphanium is sourced from PubChem (CID 3090755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).