3-(benzyloxycarbonylamino)-N-(2-bromoethyl)propionamide

HCID 20258752
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Basic information

Standard SMILES
O=C(CCNC(=O)OCc1ccccc1)NCCBr
InChIKey
ZVFLVSIWYVQFRT-UHFFFAOYSA-N
Molecular formula
C13H17BrN2O3
Average molar mass
329.19 g/mol

Names & identifiers

Preferred name
3-(benzyloxycarbonylamino)-N-(2-bromoethyl)propionamide
IUPAC
benzyl N-[3-(2-bromoethylamino)-3-oxopropyl]carbamate

Names & synonyms

SCHEMBL10953994ZVFLVSIWYVQFRT-UHFFFAOYSA-N3-(benzyloxycarbonylamino)-N-(2-bromoethyl)propionamide

Database identifiers

PubChem CID
20258752

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
67.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
19

Related reactions

4 records
New reaction record

Compound notes

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