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2-Methyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-1H-indole

HCID 16050366
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Basic information

Standard SMILES
Cc1cc2ccccc2n1-c1ccc(OCCCN2CCCC2)cc1
InChIKey
WWKLSBRCWUSDSR-UHFFFAOYSA-N
Molecular formula
C22H26N2O
Average molar mass
334.5 g/mol

Names & identifiers

Preferred name
2-Methyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-1H-indole
IUPAC
2-methyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]indole

Names & synonyms

SCHEMBL74140WWKLSBRCWUSDSR-UHFFFAOYSA-N2-Methyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-1H-indole

Database identifiers

PubChem CID
16050366

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
17.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
401

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Related reactions

4 records
New reaction record
HRID 93364 reaction equation
HRID 93364As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 491019 reaction equation
HRID 491019As productuspto-grants-2009_05
HRID 1092404 reaction equation
HRID 1092404As productuspto-grants-2012_03
HRID 2264683 reaction equation
HRID 2264683As productuspto-grants-2010_12

Compound notes

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