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

N-[2-(4-Methoxyphenyl)propyl]acetamide

HCID 14579484
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
114963-22-3
Standard SMILES
COc1ccc(C(C)CNC(C)=O)cc1
InChIKey
LCXIAGKCOYANPX-UHFFFAOYSA-N
Molecular formula
C12H17NO2
Average molar mass
207.27 g/mol
Monoisotopic mass
207.12592878

Names & identifiers

Preferred name
N-[2-(4-Methoxyphenyl)propyl]acetamide
IUPAC
N-[2-(4-methoxyphenyl)propyl]acetamide

Names & synonyms

114963-22-3N-[2-(4-Methoxyphenyl)propyl]acetamideSCHEMBL9512709DTXSID20561885LCXIAGKCOYANPX-UHFFFAOYSA-N1-acetylamino-2-(4-methoxyphenyl)propane

Database identifiers

CAS
114963-22-3
PubChem CID
14579484
DTXSID
DTXSID20561885

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
198

Related reactions

2 records
New reaction record
HRID 943120 reaction equation
HRID 943120As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1709275 reaction equation
HRID 1709275As productuspto-grants-1990_08

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes