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2,3-Dihydro-2,4,6,7-tetramethyl-2-[[4-(2-phenylethyl)-1-piperidinyl]methyl]-5-benzofuranamine

HCID 15485877
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1c(C)c2c(c(C)c1N)CC(C)(CN1CCC(CCc3ccccc3)CC1)O2
InChIKey
XUDSCITZUBSXTK-UHFFFAOYSA-N
Molecular formula
C26H36N2O
Average molar mass
392.6 g/mol

Names & identifiers

Preferred name
2,3-Dihydro-2,4,6,7-tetramethyl-2-[[4-(2-phenylethyl)-1-piperidinyl]methyl]-5-benzofuranamine
IUPAC
2,4,6,7-tetramethyl-2-[[4-(2-phenylethyl)piperidin-1-yl]methyl]-3H-1-benzofuran-5-amine

Names & synonyms

SCHEMBL6976496XUDSCITZUBSXTK-UHFFFAOYSA-N2,3-Dihydro-2,4,6,7-tetramethyl-2-[[4-(2-phenylethyl)-1-piperidinyl]methyl]-5-benzofuranamine

Database identifiers

PubChem CID
15485877

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
38.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
29
Formal charge
0
Complexity
525

Related reactions

2 records
New reaction record
HRID 565686 reaction equation
HRID 565686As productuspto-grants-2001_01
HRID 821868 reaction equation
HRID 821868As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes