N-Boc-4-(4-ethyl-piperazin-1-yl)-2,6-difluoro-phenylamine

HCID 59244991
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Basic information

Standard SMILES
CCN1CCN(c2cc(F)c(NC(=O)OC(C)(C)C)c(F)c2)CC1
InChIKey
CDZFULITGBAPPR-UHFFFAOYSA-N
Molecular formula
C17H25F2N3O2
Average molar mass
341.4 g/mol
Monoisotopic mass
341.19148337

Names & identifiers

Preferred name
N-Boc-4-(4-ethyl-piperazin-1-yl)-2,6-difluoro-phenylamine
IUPAC
tert-butyl N-[4-(4-ethylpiperazin-1-yl)-2,6-difluorophenyl]carbamate

Names & synonyms

SCHEMBL2377954CDZFULITGBAPPR-UHFFFAOYSA-NN-Boc-4-(4-ethyl-piperazin-1-yl)-2,6-difluoro-phenylamine

Database identifiers

PubChem CID
59244991

Properties

Computed structural properties

XLogP
3
Topological polar surface area
44.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
24

Related reactions

3 records
New reaction record

Compound notes

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