About [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol
[5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol (PubChem CID 115762994) has the molecular formula C10H15NO3
and a molecular weight of 197.23 g/mol. Its IUPAC name is [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol.
Molecular Properties
| Compound Name | [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol |
| PubChem CID | 115762994 |
| Molecular Formula | C10H15NO3 |
| Molecular Weight | 197.23 g/mol |
| Exact Mass | 197.11 |
| IUPAC Name | [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol |
| SMILES | OCc1ccc(CNC2(CO)CC2)o1 |
| InChI | InChI=1S/C10H15NO3/c12-6-9-2-1-8(14-9)5-11-10(7-13)3-4-10/h1-2,11-13H,3-7H2 |
| InChIKey | SIUWUOQNSKQWJW-UHFFFAOYSA-N |
| XLogP | 0.39 |
| TPSA | 65.63 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.23 |
| LogP ≤ 5 | 0.39 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol?
The IUPAC name of [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol (CID 115762994) is [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol is OCc1ccc(CNC2(CO)CC2)o1.
What is the InChIKey of [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol?
The InChIKey is SIUWUOQNSKQWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c12-6-9-2-1-8(14-9)5-11-10(7-13)3-4-10/h1-2,11-13H,3-7H2.
What are the key properties of [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol?
[5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol has a molecular weight of 197.23 g/mol, XLogP of 0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol is sourced from PubChem (CID 115762994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).