tert-butyl N-[2-chloro-5-(piperazin-1-yl)phenyl]carbamate

HCID 57840409
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Basic information

Standard SMILES
CC(C)(C)OC(=O)Nc1cc(N2CCNCC2)ccc1Cl
InChIKey
OCCNOQRYLCRAOV-UHFFFAOYSA-N
Molecular formula
C15H22ClN3O2
Average molar mass
311.81 g/mol

Names & identifiers

Preferred name
tert-butyl N-[2-chloro-5-(piperazin-1-yl)phenyl]carbamate
IUPAC
tert-butyl N-(2-chloro-5-piperazin-1-ylphenyl)carbamate

Names & synonyms

tert-butyl N-[2-chloro-5-(piperazin-1-yl)phenyl]carbamate740806-94-4SCHEMBL2870698EN300-1874275

Database identifiers

PubChem CID
57840409

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
53.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
21

Related reactions

2 records
New reaction record

Linked notes

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