HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

3-[(2-Methoxyphenyl)-piperidin-1-yl-methyl]-2-phenyl-1H-indole

HCID 10272086
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccccc1C(c1c(-c2ccccc2)[nH]c2ccccc12)N1CCCCC1
InChIKey
GNSGNUWBYTWNJJ-UHFFFAOYSA-N
Molecular formula
C27H28N2O
Average molar mass
396.5 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL5258567GNSGNUWBYTWNJJ-UHFFFAOYSA-N3-[(2-Methoxyphenyl)-piperidin-1-yl-methyl]-2-phenyl-1H-indole

Database identifiers

PubChem CID
10272086

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
28.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
30
Formal charge
0
Complexity
527

Related reactions

2 records
New reaction record
HRID 9023 reaction equation
HRID 9023As productuspto-grants-2006_08
HRID 288487 reaction equation
HRID 288487As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes