About [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol (PubChem CID 115454729) has the molecular formula C8H17NO2
and a molecular weight of 159.23 g/mol. Its IUPAC name is [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol.
Molecular Properties
| Compound Name | [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol |
| PubChem CID | 115454729 |
| Molecular Formula | C8H17NO2 |
| Molecular Weight | 159.23 g/mol |
| Exact Mass | 159.13 |
| IUPAC Name | [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol |
| SMILES | COCCNCC1(CO)CC1 |
| InChI | InChI=1S/C8H17NO2/c1-11-5-4-9-6-8(7-10)2-3-8/h9-10H,2-7H2,1H3 |
| InChIKey | UOUBDOJMVPBELP-UHFFFAOYSA-N |
| XLogP | -0.01 |
| TPSA | 41.49 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 159.23 |
| LogP ≤ 5 | -0.01 |
| H-Bond Donors ≤ 5 | 2 |
| 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 [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol (CID 115454729) is [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol is COCCNCC1(CO)CC1.
What is the InChIKey of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The InChIKey is UOUBDOJMVPBELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-11-5-4-9-6-8(7-10)2-3-8/h9-10H,2-7H2,1H3.
What are the key properties of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol has a molecular weight of 159.23 g/mol, XLogP of -0.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 115454729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).