About N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine
N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine (PubChem CID 23417724) has the molecular formula C23H66N4P2Si6
and a molecular weight of 629.27 g/mol. Its IUPAC name is N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine.
Molecular Properties
| Compound Name | N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine |
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| PubChem CID | 23417724 |
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| Molecular Formula | C23H66N4P2Si6 |
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| Molecular Weight | 629.27 g/mol |
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| Exact Mass | 628.34 |
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| IUPAC Name | N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine |
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| SMILES | CCN(CC)P(C[Si](C)(C)C)(=N[Si](C)(C)C)P(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C |
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| InChI | InChI=1S/C23H66N4P2Si6/c1-21-25(22-2)29(23-30(3,4)5,24-31(6,7)8)28(26(32(9,10)11)33(12,13)14)27(34(15,16)17)35(18,19)20/h21-23H2,1-20H3 |
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| InChIKey | RIJHEXAUTXDSTD-UHFFFAOYSA-N |
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| XLogP | 10.33 |
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| TPSA | 22.08 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 3 |
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| Rotatable Bonds | 13 |
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| Heavy Atoms | 35 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 629.27 |
| LogP ≤ 5 | 10.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine?
The IUPAC name of N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine (CID 23417724) is N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine.
What is the SMILES notation for N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine?
The canonical SMILES for N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine is CCN(CC)P(C[Si](C)(C)C)(=N[Si](C)(C)C)P(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine?
The InChIKey is RIJHEXAUTXDSTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H66N4P2Si6/c1-21-25(22-2)29(23-30(3,4)5,24-31(6,7)8)28(26(32(9,10)11)33(12,13)14)27(34(15,16)17)35(18,19)20/h21-23H2,1-20H3.
What are the key properties of N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine?
N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine has a molecular weight of 629.27 g/mol, XLogP of 10.33, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis[bis(trimethylsilyl)amino]phosphanyl-trimethylsilylimino-(trimethylsilylmethyl)-λ5-phosphanyl]-N-ethylethanamine is sourced from PubChem (CID 23417724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).