About 1H-indol-2-yl(phenyl)methanol
1H-indol-2-yl(phenyl)methanol (PubChem CID 14613765) has the molecular formula C15H13NO
and a molecular weight of 223.28 g/mol. Its IUPAC name is 1H-indol-2-yl(phenyl)methanol.
Molecular Properties
| Compound Name | 1H-indol-2-yl(phenyl)methanol |
| PubChem CID | 14613765 |
| Molecular Formula | C15H13NO |
| Molecular Weight | 223.28 g/mol |
| Exact Mass | 223.10 |
| IUPAC Name | 1H-indol-2-yl(phenyl)methanol |
| SMILES | OC(c1ccccc1)c1cc2ccccc2[nH]1 |
| InChI | InChI=1S/C15H13NO/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16-14/h1-10,15-17H |
| InChIKey | PEEIOJSRUYOBLQ-UHFFFAOYSA-N |
| XLogP | 3.25 |
| TPSA | 36.02 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 223.28 |
| LogP ≤ 5 | 3.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1H-indol-2-yl(phenyl)methanol?
The IUPAC name of 1H-indol-2-yl(phenyl)methanol (CID 14613765) is 1H-indol-2-yl(phenyl)methanol.
What is the SMILES notation for 1H-indol-2-yl(phenyl)methanol?
The canonical SMILES for 1H-indol-2-yl(phenyl)methanol is OC(c1ccccc1)c1cc2ccccc2[nH]1.
What is the InChIKey of 1H-indol-2-yl(phenyl)methanol?
The InChIKey is PEEIOJSRUYOBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16-14/h1-10,15-17H.
What are the key properties of 1H-indol-2-yl(phenyl)methanol?
1H-indol-2-yl(phenyl)methanol has a molecular weight of 223.28 g/mol, XLogP of 3.25, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-2-yl(phenyl)methanol is sourced from PubChem (CID 14613765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).