Ketipramine
Basic information
- CAS
796-29-2- Standard SMILES
CN(C)CCCN1c2ccccc2CC(=O)c2ccccc21- InChIKey
PXHIRIWYXDUSMR-UHFFFAOYSA-N- Molecular formula
- C19H22N2O
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.17321333
Overview
Ketipramine is a small molecule drug. The usage of the INN stem '-pramine' in the name indicates that Ketipramine is a substance of the imipramine group. Ketipramine has a monoisotopic molecular weight of 294.17 Da.
Names & identifiers
- Preferred name
- Ketipramine
- IUPAC
- 11-[3-(dimethylamino)propyl]-6H-benzo[b][1]benzazepin-5-one
- English name
- Ketimipramine
- Molecular formula
- C19H22N2O
- Molecular weight
- 294.39
Names & synonyms
KetimipramineKetipramineKetimipraminaKetimipraminum796-29-2U5C4H63K5UDTXSID602297905-(3-(Dimethylamino)propyl)-5,11-dihydro-10H-dibenz(b,f)azepin-10-one5-[3-(Dimethylamino)propyl]-5,11-dihydro-10H-dibenz[b,f]azepin-10-oneRefChem:151132DTXCID101522811-ALPHA-4,5-ALPHA-H-TROPANIUM, 3-ALPHA-HYDROXY-8-(P-PHENYLPHENACYL)-, (-)-TROPATE
Show more names
10H-Dibenz[b,f]azepin-10-one, 5-[3-(dimethylamino)propyl]-5,11-dihydro-
Ketimipramine [INN]Ketimipraminum [INN-Latin]UNII-U5C4H63K5UKetimipramina [INN-Spanish]11-[3-(dimethylamino)propyl]-6H-benzo[b][1]benzazepin-5-oneKetoimipramineimipramine ther10-Ketoimipramine
Database identifiers
- CAS
796-29-2- PubChem CID
- 28424
- DTXSID
DTXSID60229790- ChEMBL
CHEMBL2110856- UNII
- U5C4H63K5U
- Nikkaji
- J7.096C
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 382
Physicochemical properties
- Boiling point
- 450.8 · 450.8±45.0 °C(Predicted)
- Density
- 1.107 · 1.107±0.06 g/cm3(Predicted)
- pka
- 9.45 · 9.45±0.28(Predicted)
- FDA UNII
- 5 C4H63K5U · U5C4H63K5U
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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