About 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol
3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol (PubChem CID 64814899) has the molecular formula C19H23NO
and a molecular weight of 281.40 g/mol. Its IUPAC name is 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol.
Molecular Properties
| Compound Name | 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol |
| PubChem CID | 64814899 |
| Molecular Formula | C19H23NO |
| Molecular Weight | 281.40 g/mol |
| Exact Mass | 281.18 |
| IUPAC Name | 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol |
| SMILES | CCCNC(CCO)c1ccc2c(c1)Cc1ccccc1-2 |
| InChI | InChI=1S/C19H23NO/c1-2-10-20-19(9-11-21)15-7-8-18-16(13-15)12-14-5-3-4-6-17(14)18/h3-8,13,19-21H,2,9-12H2,1H3 |
| InChIKey | DKXQKADIOIRESD-UHFFFAOYSA-N |
| XLogP | 3.68 |
| TPSA | 32.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 281.40 |
| LogP ≤ 5 | 3.68 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol?
The IUPAC name of 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol (CID 64814899) is 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol.
What is the SMILES notation for 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol?
The canonical SMILES for 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol is CCCNC(CCO)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol?
The InChIKey is DKXQKADIOIRESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-10-20-19(9-11-21)15-7-8-18-16(13-15)12-14-5-3-4-6-17(14)18/h3-8,13,19-21H,2,9-12H2,1H3.
What are the key properties of 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol?
3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol has a molecular weight of 281.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-fluoren-2-yl)-3-(propylamino)propan-1-ol is sourced from PubChem (CID 64814899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).