About Depramine
Depramine (PubChem CID 67534) has the molecular formula C19H22N2
and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-benzo[b][1]benzazepin-11-yl-N,N-dimethylpropan-1-amine.
Molecular Properties
| Compound Name | Depramine |
| PubChem CID | 67534 |
| Molecular Formula | C19H22N2 |
| Molecular Weight | 278.40 g/mol |
| Exact Mass | 278.18 |
| IUPAC Name | 3-benzo[b][1]benzazepin-11-yl-N,N-dimethylpropan-1-amine |
| SMILES | CN(C)CCCN1C2=CC=CC=C2C=CC3=CC=CC=C31 |
| InChI | InChI=1S/C19H22N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-13H,7,14-15H2,1-2H3 |
| InChIKey | AFBYHZACPPSJKD-UHFFFAOYSA-N |
| XLogP | 5.00 |
| TPSA | 6.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | 323 |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 278.40 |
| LogP ≤ 5 | 5.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of Depramine?
The IUPAC name of Depramine (CID 67534) is 3-benzo[b][1]benzazepin-11-yl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for Depramine?
The canonical SMILES for Depramine is CN(C)CCCN1C2=CC=CC=C2C=CC3=CC=CC=C31.
What is the InChIKey of Depramine?
The InChIKey is AFBYHZACPPSJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-13H,7,14-15H2,1-2H3.
What are the key properties of Depramine?
Depramine has a molecular weight of 278.40 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Depramine is sourced from PubChem (CID 67534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).