About 6-(2-methoxyethoxy)-3-methylhexan-2-amine
6-(2-methoxyethoxy)-3-methylhexan-2-amine (PubChem CID 103410671) has the molecular formula C10H23NO2
and a molecular weight of 189.30 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-3-methylhexan-2-amine.
Molecular Properties
| Compound Name | 6-(2-methoxyethoxy)-3-methylhexan-2-amine |
| PubChem CID | 103410671 |
| Molecular Formula | C10H23NO2 |
| Molecular Weight | 189.30 g/mol |
| Exact Mass | 189.17 |
| IUPAC Name | 6-(2-methoxyethoxy)-3-methylhexan-2-amine |
| SMILES | COCCOCCCC(C)C(C)N |
| InChI | InChI=1S/C10H23NO2/c1-9(10(2)11)5-4-6-13-8-7-12-3/h9-10H,4-8,11H2,1-3H3 |
| InChIKey | RRZMCOIAINWKJG-UHFFFAOYSA-N |
| XLogP | 1.41 |
| TPSA | 44.48 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 189.30 |
| LogP ≤ 5 | 1.41 |
| H-Bond Donors ≤ 5 | 1 |
| 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 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The IUPAC name of 6-(2-methoxyethoxy)-3-methylhexan-2-amine (CID 103410671) is 6-(2-methoxyethoxy)-3-methylhexan-2-amine.
What is the SMILES notation for 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The canonical SMILES for 6-(2-methoxyethoxy)-3-methylhexan-2-amine is COCCOCCCC(C)C(C)N.
What is the InChIKey of 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
The InChIKey is RRZMCOIAINWKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-9(10(2)11)5-4-6-13-8-7-12-3/h9-10H,4-8,11H2,1-3H3.
What are the key properties of 6-(2-methoxyethoxy)-3-methylhexan-2-amine?
6-(2-methoxyethoxy)-3-methylhexan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-3-methylhexan-2-amine is sourced from PubChem (CID 103410671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).