About N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine (PubChem CID 89455641) has the molecular formula C24H38N4Si2
and a molecular weight of 438.77 g/mol. Its IUPAC name is N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine.
Molecular Properties
| Compound Name | N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine |
| PubChem CID | 89455641 |
| Molecular Formula | C24H38N4Si2 |
| Molecular Weight | 438.77 g/mol |
| Exact Mass | 438.26 |
| IUPAC Name | N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine |
| SMILES | C[Si](C)(C)N(Cc1ccccc1)/N=C/CC/C=N/N(Cc1ccccc1)[Si](C)(C)C |
| InChI | InChI=1S/C24H38N4Si2/c1-29(2,3)27(21-23-15-9-7-10-16-23)25-19-13-14-20-26-28(30(4,5)6)22-24-17-11-8-12-18-24/h7-12,15-20H,13-14,21-22H2,1-6H3/b25-19+,26-20+ |
| InChIKey | MSXKBYQFBFXQSY-FQHZWJPGSA-N |
| XLogP | 6.41 |
| TPSA | 31.20 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 438.77 |
| LogP ≤ 5 | 6.41 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The IUPAC name of N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine (CID 89455641) is N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine.
What is the SMILES notation for N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The canonical SMILES for N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine is C[Si](C)(C)N(Cc1ccccc1)/N=C/CC/C=N/N(Cc1ccccc1)[Si](C)(C)C.
What is the InChIKey of N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The InChIKey is MSXKBYQFBFXQSY-FQHZWJPGSA-N. The full InChI is InChI=1S/C24H38N4Si2/c1-29(2,3)27(21-23-15-9-7-10-16-23)25-19-13-14-20-26-28(30(4,5)6)22-24-17-11-8-12-18-24/h7-12,15-20H,13-14,21-22H2,1-6H3/b25-19+,26-20+.
What are the key properties of N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine has a molecular weight of 438.77 g/mol, XLogP of 6.41, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine is sourced from PubChem (CID 89455641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).