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[4-(6-Methoxy-2-pyridinyl)phenyl]-[2-[(2-methylpyrrolidin-1-yl)methyl]pyrrolidin-1-yl]methanone

HCID 11523748
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cccc(-c2ccc(C(=O)N3CCCC3CN3CCCC3C)cc2)n1
InChIKey
UASUHHKGKIDLJT-UHFFFAOYSA-N
Molecular formula
C23H29N3O2
Average molar mass
379.5 g/mol

Names & identifiers

Preferred name
[4-(6-Methoxy-2-pyridinyl)phenyl]-[2-[(2-methylpyrrolidin-1-yl)methyl]pyrrolidin-1-yl]methanone
IUPAC
[4-(6-methoxy-2-pyridinyl)phenyl]-[2-[(2-methylpyrrolidin-1-yl)methyl]pyrrolidin-1-yl]methanone

Names & synonyms

SCHEMBL12393124

Database identifiers

PubChem CID
11523748

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
45.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
28
Formal charge
0
Complexity
520

Related reactions

1 records
New reaction record
HRID 160867 reaction equation
HRID 160867As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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