5-(chloromethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine

HCID 59683228

Basic information

Standard SMILES
CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CCl
InChIKey
QQWJYPMRLMCIMP-UHFFFAOYSA-N
Molecular formula
C16H23ClN4O
Average molar mass
322.83 g/mol
Monoisotopic mass
322.1560391

Names & identifiers

Preferred name
5-(chloromethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine
IUPAC
5-(chloromethyl)-1,6-diethyl-N-(oxan-4-yl)pyrazolo[3,4-b]pyridin-4-amine

Names & synonyms

5-(chloromethyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amineSCHEMBL1363897QQWJYPMRLMCIMP-UHFFFAOYSA-NDB-1546725-(chloro-methyl)-1,6-diethyl-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridine-4-amine932113-90-1

Database identifiers

PubChem CID
59683228

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
52 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
22

Related reactions

5 records

Compound notes

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