tert-butyl ((1R,2S,3S,5R)-5-(3-aminopyridin-4-yl)-3-methyl-2-(2-(methylsulfonyl)ethoxy)cyclohexyl)carbamate

HCID 86705263

Basic information

Standard SMILES
C[C@H]1C[C@@H](c2ccncc2N)C[C@@H](NC(=O)OC(C)(C)C)[C@H]1OCCS(C)(=O)=O
InChIKey
FFGIFMWKPJOWBK-JFTQMJAMSA-N
Molecular formula
C20H33N3O5S
Average molar mass
427.6 g/mol

Names & identifiers

Preferred name
tert-butyl ((1R,2S,3S,5R)-5-(3-aminopyridin-4-yl)-3-methyl-2-(2-(methylsulfonyl)ethoxy)cyclohexyl)carbamate
IUPAC
tert-butyl N-[(1R,2S,3S,5R)-5-(3-amino-4-pyridinyl)-3-methyl-2-(2-methylsulfonylethoxy)cyclohexyl]carbamate

Names & synonyms

SCHEMBL15588721FFGIFMWKPJOWBK-JFTQMJAMSA-N(+/-)-tert-butyl (1R,2S,3S,5R)-5-(3-aminopyridin-4-yl)-3-methyl-2-(2-(methylsulfonyl)ethoxy)cyclohexylcarbamatetert-butyl ((1R,2S,3S,5R)-5-(3-aminopyridin-4-yl)-3-methyl-2-(2-(methylsulfonyl)ethoxy)cyclohexyl)carbamate

Database identifiers

PubChem CID
86705263

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
129 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
29

Related reactions

4 records

Compound notes

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