1-Cyclohexylmethyl-2-oxo-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carboxylic acid (2-oxo-tetrahydrofuran-3-yl)-amide

HCID 59718878

Basic information

Standard SMILES
O=C(NC1CCOC1=O)c1cc2c(n(CC3CCCCC3)c1=O)CCCCCC2
InChIKey
MVKQVISAUJGYHQ-UHFFFAOYSA-N
Molecular formula
C23H32N2O4
Average molar mass
400.5 g/mol

Names & identifiers

Preferred name
1-Cyclohexylmethyl-2-oxo-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carboxylic acid (2-oxo-tetrahydrofuran-3-yl)-amide
IUPAC
1-(cyclohexylmethyl)-2-oxo-N-(2-oxooxolan-3-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carboxamide

Names & synonyms

SCHEMBL5510902MVKQVISAUJGYHQ-UHFFFAOYSA-N1-cyclohexylmethyl-2-oxo-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carboxylic acid (2-oxo-tetrahydrofuran-3-yl)-amide

Database identifiers

PubChem CID
59718878

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
75.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
29

Related reactions

3 records

Compound notes

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