About aminomethyl(triphenyl)phosphanium
aminomethyl(triphenyl)phosphanium (PubChem CID 155040126) has the molecular formula C19H19NP+
and a molecular weight of 292.34 g/mol. Its IUPAC name is aminomethyl(triphenyl)phosphanium.
Molecular Properties
| Compound Name | aminomethyl(triphenyl)phosphanium |
| PubChem CID | 155040126 |
| Molecular Formula | C19H19NP+ |
| Molecular Weight | 292.34 g/mol |
| Exact Mass | 292.12 |
| IUPAC Name | aminomethyl(triphenyl)phosphanium |
| SMILES | NC[P+](c1ccccc1)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C19H19NP/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16,20H2/q+1 |
| InChIKey | MMIKRZIPNFCVKR-UHFFFAOYSA-N |
| XLogP | 2.90 |
| TPSA | 26.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 292.34 |
| LogP ≤ 5 | 2.90 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of aminomethyl(triphenyl)phosphanium?
The IUPAC name of aminomethyl(triphenyl)phosphanium (CID 155040126) is aminomethyl(triphenyl)phosphanium.
What is the SMILES notation for aminomethyl(triphenyl)phosphanium?
The canonical SMILES for aminomethyl(triphenyl)phosphanium is NC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of aminomethyl(triphenyl)phosphanium?
The InChIKey is MMIKRZIPNFCVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NP/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16,20H2/q+1.
What are the key properties of aminomethyl(triphenyl)phosphanium?
aminomethyl(triphenyl)phosphanium has a molecular weight of 292.34 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aminomethyl(triphenyl)phosphanium is sourced from PubChem (CID 155040126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).