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

1-[4-(4-Phenyl-1,2,3,6-tetrahydro-1-pyridyl)butyl]indole

HCID 21997881
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C1=C(c2ccccc2)CCN(CCCCn2ccc3ccccc32)C1
InChIKey
PBQAWSXIFXCVMW-UHFFFAOYSA-N
Molecular formula
C23H26N2
Average molar mass
330.5 g/mol

Names & identifiers

Preferred name
1-[4-(4-Phenyl-1,2,3,6-tetrahydro-1-pyridyl)butyl]indole
IUPAC
1-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]indole

Names & synonyms

SCHEMBL6162196PBQAWSXIFXCVMW-UHFFFAOYSA-N1-[4-(4-phenyl-1,2,3,6-tetrahydro-1-pyridyl)butyl]indole

Database identifiers

PubChem CID
21997881

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
8.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
437

Related reactions

2 records
New reaction record
HRID 2787 reaction equation
HRID 2787As productuspto-grants-1998_03
HRID 1977252 reaction equation
HRID 1977252As productuspto-grants-2001_05

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes