About N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine
N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine (PubChem CID 170129105) has the molecular formula C10H24N2O
and a molecular weight of 188.31 g/mol. Its IUPAC name is N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine.
Molecular Properties
| Compound Name | N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine |
| PubChem CID | 170129105 |
| Molecular Formula | C10H24N2O |
| Molecular Weight | 188.31 g/mol |
| Exact Mass | 188.19 |
| IUPAC Name | N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine |
| SMILES | CC(C)N(C)CCOCCN(C)C |
| InChI | InChI=1S/C10H24N2O/c1-10(2)12(5)7-9-13-8-6-11(3)4/h10H,6-9H2,1-5H3 |
| InChIKey | WZNGEPUJLNZNKZ-UHFFFAOYSA-N |
| XLogP | 0.90 |
| TPSA | 15.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 188.31 |
| LogP ≤ 5 | 0.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The IUPAC name of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine (CID 170129105) is N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine is CC(C)N(C)CCOCCN(C)C.
What is the InChIKey of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
The InChIKey is WZNGEPUJLNZNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-10(2)12(5)7-9-13-8-6-11(3)4/h10H,6-9H2,1-5H3.
What are the key properties of N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine?
N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine has a molecular weight of 188.31 g/mol, XLogP of 0.90, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(dimethylamino)ethoxy]ethyl]-N-methylpropan-2-amine is sourced from PubChem (CID 170129105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).