About 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol
5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol (PubChem CID 66057155) has the molecular formula C11H22N2O2
and a molecular weight of 214.31 g/mol. Its IUPAC name is 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol.
Molecular Properties
| Compound Name | 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol |
| PubChem CID | 66057155 |
| Molecular Formula | C11H22N2O2 |
| Molecular Weight | 214.31 g/mol |
| Exact Mass | 214.17 |
| IUPAC Name | 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol |
| SMILES | COC1CCCC1NCC1CC(O)CN1 |
| InChI | InChI=1S/C11H22N2O2/c1-15-11-4-2-3-10(11)13-6-8-5-9(14)7-12-8/h8-14H,2-7H2,1H3 |
| InChIKey | UHVBLDWGLYVUSR-UHFFFAOYSA-N |
| XLogP | -0.13 |
| TPSA | 53.52 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.31 |
| LogP ≤ 5 | -0.13 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol?
The IUPAC name of 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol (CID 66057155) is 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol.
What is the SMILES notation for 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol?
The canonical SMILES for 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol is COC1CCCC1NCC1CC(O)CN1.
What is the InChIKey of 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol?
The InChIKey is UHVBLDWGLYVUSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-15-11-4-2-3-10(11)13-6-8-5-9(14)7-12-8/h8-14H,2-7H2,1H3.
What are the key properties of 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol?
5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol has a molecular weight of 214.31 g/mol, XLogP of -0.13, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2-methoxycyclopentyl)amino]methyl]pyrrolidin-3-ol is sourced from PubChem (CID 66057155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).