methyl (S)-3-tert-butoxycarbonylamino-2-(4-ethylpiperazin-1-yl)propanoate

HCID 86667916
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Basic information

Standard SMILES
CCN1CCN([C@@H](CNC(=O)OC(C)(C)C)C(=O)OC)CC1
InChIKey
LPVFNWJUOZKLKW-LBPRGKRZSA-N
Molecular formula
C15H29N3O4
Average molar mass
315.41 g/mol

Names & identifiers

Preferred name
methyl (S)-3-tert-butoxycarbonylamino-2-(4-ethylpiperazin-1-yl)propanoate
IUPAC
methyl (2S)-2-(4-ethylpiperazin-1-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Names & synonyms

LPVFNWJUOZKLKW-LBPRGKRZSA-Nmethyl (S)-3-tert-butoxycarbonylamino-2-(4-ethylpiperazin-1-yl)propanoate

Database identifiers

PubChem CID
86667916

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
71.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
22

Related reactions

9 records
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Compound notes

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