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3-[(2-methoxyphenyl)-pyrrolidin-1-yl-methyl]-2-phenyl-1H-indole

HCID 10177959
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccccc1C(c1c(-c2ccccc2)[nH]c2ccccc12)N1CCCC1
InChIKey
NQFISGAKJWNESU-UHFFFAOYSA-N
Molecular formula
C26H26N2O
Average molar mass
382.5 g/mol

Names & identifiers

Preferred name
3-[(2-methoxyphenyl)-pyrrolidin-1-yl-methyl]-2-phenyl-1H-indole
IUPAC
3-[(2-methoxyphenyl)-pyrrolidin-1-ylmethyl]-2-phenyl-1H-indole

Names & synonyms

SCHEMBL5259027NQFISGAKJWNESU-UHFFFAOYSA-N3-[(2-methoxyphenyl)-pyrrolidin-1-yl-methyl]-2-phenyl-1H-indole

Database identifiers

PubChem CID
10177959

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
28.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
29
Formal charge
0
Complexity
513

Related reactions

2 records
New reaction record
HRID 9014 reaction equation
HRID 9014As productuspto-grants-2006_08
HRID 662370 reaction equation
HRID 662370As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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