About [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol
[2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol (PubChem CID 115103335) has the molecular formula C10H15NO2
and a molecular weight of 181.24 g/mol. Its IUPAC name is [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol.
Molecular Properties
| Compound Name | [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol |
| PubChem CID | 115103335 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.24 g/mol |
| Exact Mass | 181.11 |
| IUPAC Name | [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol |
| SMILES | Cc1ccc(C2(CO)CCCN2)o1 |
| InChI | InChI=1S/C10H15NO2/c1-8-3-4-9(13-8)10(7-12)5-2-6-11-10/h3-4,11-12H,2,5-7H2,1H3 |
| InChIKey | GXMKWLCPXZRMMD-UHFFFAOYSA-N |
| XLogP | 1.16 |
| TPSA | 45.40 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 181.24 |
| LogP ≤ 5 | 1.16 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol (CID 115103335) is [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol is Cc1ccc(C2(CO)CCCN2)o1.
What is the InChIKey of [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol?
The InChIKey is GXMKWLCPXZRMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-8-3-4-9(13-8)10(7-12)5-2-6-11-10/h3-4,11-12H,2,5-7H2,1H3.
What are the key properties of [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol?
[2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol has a molecular weight of 181.24 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-methylfuran-2-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 115103335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).