About [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol
[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol (PubChem CID 81212944) has the molecular formula C12H23NO3
and a molecular weight of 229.32 g/mol. Its IUPAC name is [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol.
Molecular Properties
| Compound Name | [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol |
| PubChem CID | 81212944 |
| Molecular Formula | C12H23NO3 |
| Molecular Weight | 229.32 g/mol |
| Exact Mass | 229.17 |
| IUPAC Name | [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol |
| SMILES | OCC1CN(CC2(CO)CCCC2)CCO1 |
| InChI | InChI=1S/C12H23NO3/c14-8-11-7-13(5-6-16-11)9-12(10-15)3-1-2-4-12/h11,14-15H,1-10H2 |
| InChIKey | YCHNDHDWGWMRIL-UHFFFAOYSA-N |
| XLogP | 0.23 |
| TPSA | 52.93 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.32 |
| LogP ≤ 5 | 0.23 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol (CID 81212944) is [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol is OCC1CN(CC2(CO)CCCC2)CCO1.
What is the InChIKey of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
The InChIKey is YCHNDHDWGWMRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c14-8-11-7-13(5-6-16-11)9-12(10-15)3-1-2-4-12/h11,14-15H,1-10H2.
What are the key properties of [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol?
[4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol has a molecular weight of 229.32 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[1-(hydroxymethyl)cyclopentyl]methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81212944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).