1-[2-Fluoro-5-(methyloxy)-4-nitrophenyl]-4-(1-methylethyl)piperazine

HCID 59442011
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cc(N2CCN(C(C)C)CC2)c(F)cc1[N+](=O)[O-]
InChIKey
ZTJRLWMJHLMJQV-UHFFFAOYSA-N
Molecular formula
C14H20FN3O3
Average molar mass
297.33 g/mol

Names & identifiers

Preferred name
1-[2-Fluoro-5-(methyloxy)-4-nitrophenyl]-4-(1-methylethyl)piperazine
IUPAC
1-(2-fluoro-5-methoxy-4-nitrophenyl)-4-propan-2-ylpiperazine

Names & synonyms

SCHEMBL2206124ZTJRLWMJHLMJQV-UHFFFAOYSA-N1-[2-fluoro-5-(methyloxy)-4-nitrophenyl]-4-(1-methylethyl)piperazine

Database identifiers

PubChem CID
59442011

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
61.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
21

Related reactions

4 records
New reaction record

Compound notes

Loading…