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5-cyclopropyl-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-(oxolan-2-ylmethoxy)pyridine-2-carboxamide

HCID 71087617
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CNC(=O)C(CC(C)C)NC(=O)c1ccc(C2CC2)c(OCC2CCCO2)n1
InChIKey
HFQIXSJGSFSITI-UHFFFAOYSA-N
Molecular formula
C21H31N3O4
Average molar mass
389.5 g/mol
Monoisotopic mass
389.23145648

Names & identifiers

Preferred name
5-cyclopropyl-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-(oxolan-2-ylmethoxy)pyridine-2-carboxamide
IUPAC
5-cyclopropyl-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]-6-(oxolan-2-ylmethoxy)pyridine-2-carboxamide

Names & synonyms

SCHEMBL14152245

Database identifiers

PubChem CID
71087617

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
89.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
28
Formal charge
0
Complexity
538

Related reactions

1 records
New reaction record
HRID 193900 reaction equation
HRID 193900As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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