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N-[2-(docosa-4,7,10,13,16,19-hexaenoylamino)ethyl]pyridine-3-carboxamide

HCID 69809389
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Substructure searchFind similar structures

Basic information

Standard SMILES
CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)NCCNC(=O)c1cccnc1
InChIKey
SNLURFYICMIFHS-UHFFFAOYSA-N
Molecular formula
C30H41N3O2
Average molar mass
475.7 g/mol

Names & identifiers

Preferred name
N-[2-(docosa-4,7,10,13,16,19-hexaenoylamino)ethyl]pyridine-3-carboxamide
IUPAC
N-[2-(docosa-4,7,10,13,16,19-hexaenoylamino)ethyl]pyridine-3-carboxamide

Names & synonyms

SCHEMBL6517556

Database identifiers

PubChem CID
69809389

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
71.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
18
Heavy atoms
35
Formal charge
0
Complexity
732

Related reactions

1 records
New reaction record
HRID 98441 reaction equation
HRID 98441As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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