About [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol
[1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol (PubChem CID 110011599) has the molecular formula C14H27NO2
and a molecular weight of 241.37 g/mol. Its IUPAC name is [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol.
Molecular Properties
| Compound Name | [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol |
| PubChem CID | 110011599 |
| Molecular Formula | C14H27NO2 |
| Molecular Weight | 241.37 g/mol |
| Exact Mass | 241.20 |
| IUPAC Name | [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol |
| SMILES | CC(C)(C)OC1CC(NC2(CO)CCCC2)C1 |
| InChI | InChI=1S/C14H27NO2/c1-13(2,3)17-12-8-11(9-12)15-14(10-16)6-4-5-7-14/h11-12,15-16H,4-10H2,1-3H3 |
| InChIKey | PYBYRUITPQIZPV-UHFFFAOYSA-N |
| XLogP | 2.23 |
| TPSA | 41.49 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.37 |
| LogP ≤ 5 | 2.23 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol?
The IUPAC name of [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol (CID 110011599) is [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol?
The canonical SMILES for [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol is CC(C)(C)OC1CC(NC2(CO)CCCC2)C1.
What is the InChIKey of [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol?
The InChIKey is PYBYRUITPQIZPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-13(2,3)17-12-8-11(9-12)15-14(10-16)6-4-5-7-14/h11-12,15-16H,4-10H2,1-3H3.
What are the key properties of [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol?
[1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol has a molecular weight of 241.37 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]cyclopentyl]methanol is sourced from PubChem (CID 110011599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).