About [1-(cyclobutylmethyl)indol-5-yl]methanol
[1-(cyclobutylmethyl)indol-5-yl]methanol (PubChem CID 117118884) has the molecular formula C14H17NO
and a molecular weight of 215.30 g/mol. Its IUPAC name is [1-(cyclobutylmethyl)indol-5-yl]methanol.
Molecular Properties
| Compound Name | [1-(cyclobutylmethyl)indol-5-yl]methanol |
| PubChem CID | 117118884 |
| Molecular Formula | C14H17NO |
| Molecular Weight | 215.30 g/mol |
| Exact Mass | 215.13 |
| IUPAC Name | [1-(cyclobutylmethyl)indol-5-yl]methanol |
| SMILES | OCc1ccc2c(ccn2CC2CCC2)c1 |
| InChI | InChI=1S/C14H17NO/c16-10-12-4-5-14-13(8-12)6-7-15(14)9-11-2-1-3-11/h4-8,11,16H,1-3,9-10H2 |
| InChIKey | ILELAOVWUYHJOQ-UHFFFAOYSA-N |
| XLogP | 2.93 |
| TPSA | 25.16 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 215.30 |
| LogP ≤ 5 | 2.93 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of [1-(cyclobutylmethyl)indol-5-yl]methanol?
The IUPAC name of [1-(cyclobutylmethyl)indol-5-yl]methanol (CID 117118884) is [1-(cyclobutylmethyl)indol-5-yl]methanol.
What is the SMILES notation for [1-(cyclobutylmethyl)indol-5-yl]methanol?
The canonical SMILES for [1-(cyclobutylmethyl)indol-5-yl]methanol is OCc1ccc2c(ccn2CC2CCC2)c1.
What is the InChIKey of [1-(cyclobutylmethyl)indol-5-yl]methanol?
The InChIKey is ILELAOVWUYHJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c16-10-12-4-5-14-13(8-12)6-7-15(14)9-11-2-1-3-11/h4-8,11,16H,1-3,9-10H2.
What are the key properties of [1-(cyclobutylmethyl)indol-5-yl]methanol?
[1-(cyclobutylmethyl)indol-5-yl]methanol has a molecular weight of 215.30 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclobutylmethyl)indol-5-yl]methanol is sourced from PubChem (CID 117118884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).