2-(3-(Di(propan-2-yl)amino)-1-phenylpropyl)-4-methylphenol

HCID 5512

Basic information

Standard SMILES
Cc1ccc(O)c(C(CCN(C(C)C)C(C)C)c2ccccc2)c1
InChIKey
OOGJQPCLVADCPB-UHFFFAOYSA-N
Molecular formula
C22H31NO
Average molar mass
325.5 g/mol

Overview

See also: Tolterodine (annotation moved to).

Names & identifiers

Preferred name
2-(3-(Di(propan-2-yl)amino)-1-phenylpropyl)-4-methylphenol
IUPAC
2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol

Names & synonyms

2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol2-(3-(Di(propan-2-yl)amino)-1-phenylpropyl)-4-methylphenolRefChem:1061045DTXCID10209345DTXSID70861286124936-74-92-(3-(Diisopropylamino)-1-phenylpropyl)-4-methylphenol2-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-methylphenolTolterodine Impurity 42-{3-[bis(propan-2-yl)amino]-1-phenylpropyl}-4-methylphenoltolterodinTolterodine (racemate)
Show more names
OOGJQPCLVADCPB-UHFFFAOYSA-NPNU-200583 racemate; PNU 200583 racemate; PNU200583 racemate; (+/-)-Tolterodine; Racemic tolterodineSpectrum_0016342-[3-[Bis(1-Methylethyl)Amino]-1-Phenylpropyl]-4-Methyl Phenol Monohydrobromide2,3-BIS(1-METHYLETHYL)AMINO-1-PHENYLPROPYL-4-METHYLPHENOLSpectrum2_000526Spectrum3_001003Spectrum4_001131

Database identifiers

PubChem CID
5512
ChEMBL
CHEMBL319757

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
24

Experimental & physicochemical properties

DrugsPharmaceuticals

Related reactions

9 records

Linked notes

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