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

5-Acetylamino-2-(1-phenylethylamino)-tetraline

HCID 14836573
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1cccc2c1CCC(NC(C)c1ccccc1)C2
InChIKey
TWIFURKQNJSNAN-UHFFFAOYSA-N
Molecular formula
C20H24N2O
Average molar mass
308.4 g/mol
Monoisotopic mass
308.18886339

Names & identifiers

Preferred name
5-Acetylamino-2-(1-phenylethylamino)-tetraline
IUPAC
N-[6-(1-phenylethylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide

Names & synonyms

SCHEMBL7332501TWIFURKQNJSNAN-UHFFFAOYSA-N5-Acetylamino-2-(1-phenylethylamino)-tetraline

Database identifiers

PubChem CID
14836573

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
41.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
23
Formal charge
0
Complexity
391

Related reactions

2 records
New reaction record
HRID 155999 reaction equation
HRID 155999As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1614273 reaction equation
HRID 1614273As productuspto-grants-1993_03

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes