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9-(2'-(Hydroxymethyl)-3'-methylcyclobutyl)adenine

HCID 19794329
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1CC(n2cnc3c(N)ncnc32)C1CO
InChIKey
QUSVOHNJLLJBMO-UHFFFAOYSA-N
Molecular formula
C11H15N5O
Average molar mass
233.27 g/mol

Names & identifiers

Preferred name
9-(2'-(Hydroxymethyl)-3'-methylcyclobutyl)adenine
IUPAC
[2-(6-aminopurin-9-yl)-4-methylcyclobutyl]methanol

Names & synonyms

SCHEMBL9471366QUSVOHNJLLJBMO-UHFFFAOYSA-N9-(2'-(Hydroxymethyl)-3'-methylcyclobutyl)adenine

Database identifiers

PubChem CID
19794329

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
89.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
289

Related reactions

3 records
New reaction record
HRID 5955 reaction equation
HRID 5955As productuspto-grants-1993_09
HRID 465750 reaction equation
HRID 465750As productuspto-grants-1992_10
HRID 1561083 reaction equation
HRID 1561083As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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