About N-bromosilyl-N-methylpropan-2-amine
N-bromosilyl-N-methylpropan-2-amine (PubChem CID 140711237) has the molecular formula C4H12BrNSi
and a molecular weight of 182.14 g/mol. Its IUPAC name is N-bromosilyl-N-methylpropan-2-amine.
Molecular Properties
| Compound Name | N-bromosilyl-N-methylpropan-2-amine |
| PubChem CID | 140711237 |
| Molecular Formula | C4H12BrNSi |
| Molecular Weight | 182.14 g/mol |
| Exact Mass | 180.99 |
| IUPAC Name | N-bromosilyl-N-methylpropan-2-amine |
| SMILES | CC(C)N(C)[SiH2]Br |
| InChI | InChI=1S/C4H12BrNSi/c1-4(2)6(3)7-5/h4H,7H2,1-3H3 |
| InChIKey | NKFUNNQLNXWSKJ-UHFFFAOYSA-N |
| XLogP | 0.72 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 7 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.14 |
| LogP ≤ 5 | 0.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-bromosilyl-N-methylpropan-2-amine?
The IUPAC name of N-bromosilyl-N-methylpropan-2-amine (CID 140711237) is N-bromosilyl-N-methylpropan-2-amine.
What is the SMILES notation for N-bromosilyl-N-methylpropan-2-amine?
The canonical SMILES for N-bromosilyl-N-methylpropan-2-amine is CC(C)N(C)[SiH2]Br.
What is the InChIKey of N-bromosilyl-N-methylpropan-2-amine?
The InChIKey is NKFUNNQLNXWSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12BrNSi/c1-4(2)6(3)7-5/h4H,7H2,1-3H3.
What are the key properties of N-bromosilyl-N-methylpropan-2-amine?
N-bromosilyl-N-methylpropan-2-amine has a molecular weight of 182.14 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-bromosilyl-N-methylpropan-2-amine is sourced from PubChem (CID 140711237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).