benzyl N-[(1S,3R)-3-cyanocyclohexyl]carbamate

HCID 23584440
Substructure searchFind similar structures

Basic information

Standard SMILES
N#C[C@@H]1CCC[C@H](NC(=O)OCc2ccccc2)C1
InChIKey
YWGLYHLOMGCOOC-KGLIPLIRSA-N
Molecular formula
C15H18N2O2
Average molar mass
258.32 g/mol

Names & identifiers

Preferred name
benzyl N-[(1S,3R)-3-cyanocyclohexyl]carbamate
IUPAC
benzyl N-[(1S,3R)-3-cyanocyclohexyl]carbamate

Names & synonyms

benzyl N-[(1S,3R)-3-cyanocyclohexyl]carbamateSCHEMBL10008090YWGLYHLOMGCOOC-KGLIPLIRSA-Nbenzyl (1S,3R)-3-cyanocyclohexylcarbamate

Database identifiers

PubChem CID
23584440
Nikkaji
J2.724.065H

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
62.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
19

Related reactions

4 records
New reaction record

Linked notes

Loading…