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2-[3-(2-Dimethylaminoethoxy)phenyl]oxazolo[4,5-b]pyridine

HCID 22754792
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CN(C)CCOc1cccc(-c2nc3ncccc3o2)c1
InChIKey
BMUWNHPFIREPAT-UHFFFAOYSA-N
Molecular formula
C16H17N3O2
Average molar mass
283.32 g/mol
Monoisotopic mass
283.13207679

Names & identifiers

Preferred name
2-[3-(2-Dimethylaminoethoxy)phenyl]oxazolo[4,5-b]pyridine
IUPAC
N,N-dimethyl-2-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenoxy]ethanamine

Names & synonyms

SCHEMBL11646586BMUWNHPFIREPAT-UHFFFAOYSA-N2-[3-(2-dimethylaminoethoxy)phenyl]oxazolo[4,5-b]pyridine

Database identifiers

PubChem CID
22754792

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
51.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
327

Related reactions

3 records
New reaction record
HRID 66384 reaction equation
HRID 66384As productuspto-grants-1978_12
HRID 157268 reaction equation
HRID 157268As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 259572 reaction equation
HRID 259572As productuspto-grants-1977_07

Compound notes

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