HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Benzenamine, 4-[2-(4-quinolinyl)ethenyl]-

HCID 5929136
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
54-00-2
Standard SMILES
Nc1ccc(/C=C/c2ccnc3ccccc23)cc1
InChIKey
ZAEBBDZNEDAXHL-VMPITWQZSA-N
Molecular formula
C17H14N2
Average molar mass
246.31 g/mol
Monoisotopic mass
246.11569846

Names & identifiers

Preferred name
Benzenamine, 4-[2-(4-quinolinyl)ethenyl]-
IUPAC
4-[(E)-2-quinolin-4-ylethenyl]aniline

Names & synonyms

54-00-2Benzenamine, 4-[2-(4-quinolinyl)ethenyl]-4-(2-(Quinolin-4-yl)vinyl)aniline4-[2-(quinolin-4-yl)ethenyl]anilineNSC590654-p-Diaminostyrylquinone4-[(E)-2-quinolin-4-ylethenyl]aniline4-[2-(4-quinolinyl)vinyl]phenylamineQuinoline, 4-(4-aminostyryl)CHEMBL1986365Quinoline, 4-(p-aminostyryl)-4-(4-amino-trans-styryl)quinoline
Show more names
NSC-590654-[(E)-2-(4-quinolyl)vinyl]anilineNCGC00184051-01NCGC00184051-02NCGC00184051-03NCGC00184051-04NCGC00184051-05NCGC00184051-06

Database identifiers

CAS
54-00-2
PubChem CID
5929136
ChEMBL
CHEMBL1986365

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
38.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
304

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes