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2-Amino-1-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)butan-1-ol (HCID 21962741)|Huagongshe
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Compound
2-Amino-1-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)butan-1-ol
HCID
21962741
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Basic information
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Properties
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Basic information
Standard SMILES
CCC(N)C(O)c1nnc(-c2cccnc2)o1
InChIKey
QCVYYZQJZVAFNO-UHFFFAOYSA-N
Molecular formula
C11H14N4O2
Average molar mass
234.25 g/mol
Monoisotopic mass
234.1116757
Names & identifiers
Preferred name
2-Amino-1-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)butan-1-ol
IUPAC
2-amino-1-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)butan-1-ol
Names & synonyms
SCHEMBL3622574
Database identifiers
PubChem CID
21962741
Properties
Computed structural properties
XLogP
-0.5
Topological polar surface area
98.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
242
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Related reactions
1 records
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As product
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As solvent
HRID
832682
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
Compound notes
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