About 3-(1H-inden-2-yl)-1H-inden-2-ol
3-(1H-inden-2-yl)-1H-inden-2-ol (PubChem CID 20693143) has the molecular formula C18H14O
and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(1H-inden-2-yl)-1H-inden-2-ol.
Molecular Properties
| Compound Name | 3-(1H-inden-2-yl)-1H-inden-2-ol |
| PubChem CID | 20693143 |
| Molecular Formula | C18H14O |
| Molecular Weight | 246.31 g/mol |
| Exact Mass | 246.10 |
| IUPAC Name | 3-(1H-inden-2-yl)-1H-inden-2-ol |
| SMILES | OC1=C(C2=Cc3ccccc3C2)c2ccccc2C1 |
| InChI | InChI=1S/C18H14O/c19-17-11-14-7-3-4-8-16(14)18(17)15-9-12-5-1-2-6-13(12)10-15/h1-9,19H,10-11H2 |
| InChIKey | YSWSOXXIILHGHH-UHFFFAOYSA-N |
| XLogP | 4.15 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 246.31 |
| LogP ≤ 5 | 4.15 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-(1H-inden-2-yl)-1H-inden-2-ol?
The IUPAC name of 3-(1H-inden-2-yl)-1H-inden-2-ol (CID 20693143) is 3-(1H-inden-2-yl)-1H-inden-2-ol.
What is the SMILES notation for 3-(1H-inden-2-yl)-1H-inden-2-ol?
The canonical SMILES for 3-(1H-inden-2-yl)-1H-inden-2-ol is OC1=C(C2=Cc3ccccc3C2)c2ccccc2C1.
What is the InChIKey of 3-(1H-inden-2-yl)-1H-inden-2-ol?
The InChIKey is YSWSOXXIILHGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O/c19-17-11-14-7-3-4-8-16(14)18(17)15-9-12-5-1-2-6-13(12)10-15/h1-9,19H,10-11H2.
What are the key properties of 3-(1H-inden-2-yl)-1H-inden-2-ol?
3-(1H-inden-2-yl)-1H-inden-2-ol has a molecular weight of 246.31 g/mol, XLogP of 4.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-inden-2-yl)-1H-inden-2-ol is sourced from PubChem (CID 20693143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).