Trimethyldiphenylpropylamine
Basic information
- CAS
13957-55-6- Standard SMILES
CC(CC(c1ccccc1)c1ccccc1)N(C)C- InChIKey
NSHMKXVHJBBKTN-UHFFFAOYSA-N- Molecular formula
- C18H23N
- Average molar mass
- 253.4 g/mol
- Monoisotopic mass
- 253.18304974
Overview
Trimethyldiphenylpropylamine is a diarylmethane.
Names & identifiers
- Preferred name
- Trimethyldiphenylpropylamine
- IUPAC
- N,N-dimethyl-4,4-diphenylbutan-2-amine
- English name
- N,N,α-Trimethyl-γ-phenylbenzenepropan-1-amine
- Molecular formula
- C18H23N
- Molecular weight
- 253.38192
Names & synonyms
Trimethyldiphenylpropylamine13957-55-6N,N,1-Trimethyl-3,3-diphenylpropylamineN,N-dimethyl-4,4-diphenylbutan-2-amineUNII-P4X899446UMethadone Impurity 30Propylamine, N,N,1-trimethyl-3,3-diphenyl-P4X899446UBenzenepropanamine, N,N,alpha-trimethyl-gamma-phenyl-N,N,alpha-Trimethyl-gamma-phenylbenzenepropan-1-amineBenzenepropanamine, N,N,.alpha.-trimethyl-.gamma.-phenyl-N,N-Dimethyl-4,4-diphenyl-2-butanamine
Show more names
RecipavrinN,N,α-Trimethyl-γ-phenylbenzenepropan-1-amine
N,N-Dimethyl-(3,3-diphenyl-1-methylpropyl)aminen,n-1-trimethyl-3,3-diphenylpropylamineRecipavrin (Salt/Mix)Recipavrine (Salt/Mix)SCHEMBL25589CHEMBL3707363CHEBI:136024NSHMKXVHJBBKTN-UHFFFAOYSA-N
Database identifiers
- CAS
13957-55-6- PubChem CID
- 30966
- DTXSID
DTXSID801043073- ChEMBL
CHEMBL3707363- ChEBI
CHEBI:136024- UNII
- P4X899446U
- Nikkaji
- J111.362C
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- storage temp.
- Refrigerator
- solubility
- Chloroform, Dichloromethane, Ethyacetate
- FDA UNII
- 4 X899446U · P4X899446U
Chemistry & industry
Pharmacology
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
Applications
UsesN,N,1-Trimethyl-3,3-diphenylpropylamine is an intermediate in the synthesis of Emepronium Bromide which is an antispasmodic. Used in treatment of urinary incontinence. Anticholinergic overactive bladder.
Additional notes
DefinitionChEBI: Trimethyldiphenylpropylamine is a diarylmethane.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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