4-(4-Acetyl-1,4-diazepan-1-yl)aniline

HCID 28809123

Basic information

Standard SMILES
CC(=O)N1CCCN(c2ccc(N)cc2)CC1
InChIKey
NAGIUNDJXZEGFW-UHFFFAOYSA-N
Molecular formula
C13H19N3O
Average molar mass
233.31 g/mol

Names & identifiers

Preferred name
4-(4-Acetyl-1,4-diazepan-1-yl)aniline
IUPAC
1-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethanone

Names & synonyms

497249-28-24-(4-Acetyl-1,4-diazepan-1-yl)aniline1-(4-(4-Aminophenyl)-1,4-diazepan-1-yl)ethanone1-[4-(4-aminophenyl)-1,4-diazepan-1-yl]ethan-1-one1-[4-(4-AMINOPHENYL)-1,4-DIAZEPAN-1-YL]ETHANONE1-(4-(4-Aminophenyl)-1,4-diazepan-1-yl)ethan-1-oneMFCD10036744SCHEMBL3548441NAGIUNDJXZEGFW-UHFFFAOYSA-NAKOS0108595744-(4-Acetylhomopiperazin-1-yl)anilineCS-0272191
Show more names
EN300-238781[4-(4-acetyl-1,4-diazepan-1-yl)phenyl]amine

Database identifiers

PubChem CID
28809123

Properties

Computed structural properties

XLogP
1
Topological polar surface area
49.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17

Related reactions

2 records

Compound notes

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