About N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine
N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine (PubChem CID 4185604) has the molecular formula C10H24NO2P
and a molecular weight of 221.28 g/mol. Its IUPAC name is N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine.
Molecular Properties
| Compound Name | N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine |
| PubChem CID | 4185604 |
| Molecular Formula | C10H24NO2P |
| Molecular Weight | 221.28 g/mol |
| Exact Mass | 221.15 |
| IUPAC Name | N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine |
| SMILES | CCOP(OCC)N(C(C)C)C(C)C |
| InChI | InChI=1S/C10H24NO2P/c1-7-12-14(13-8-2)11(9(3)4)10(5)6/h9-10H,7-8H2,1-6H3 |
| InChIKey | UUFIBXKHKNIZHL-UHFFFAOYSA-N |
| XLogP | 3.41 |
| TPSA | 21.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 221.28 |
| LogP ≤ 5 | 3.41 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine (CID 4185604) is N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine is CCOP(OCC)N(C(C)C)C(C)C.
What is the InChIKey of N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The InChIKey is UUFIBXKHKNIZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24NO2P/c1-7-12-14(13-8-2)11(9(3)4)10(5)6/h9-10H,7-8H2,1-6H3.
What are the key properties of N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine has a molecular weight of 221.28 g/mol, XLogP of 3.41, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-diethoxyphosphanyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 4185604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).