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N-(2-morpholinophenyl)isobutyramidine (HCID 178449872)|Huagongshe
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Compound
N-(2-morpholinophenyl)isobutyramidine
HCID
178449872
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CC(C)C(=N)Nc1ccccc1N1CCOCC1
InChIKey
WECUSHSUUIHVCH-UHFFFAOYSA-N
Molecular formula
C14H21N3O
Average molar mass
247.34 g/mol
Monoisotopic mass
247.1684623
Names & identifiers
Preferred name
N-(2-morpholinophenyl)isobutyramidine
IUPAC
2-methyl-N'-(2-morpholin-4-ylphenyl)propanimidamide
Names & synonyms
SCHEMBL9059408
WECUSHSUUIHVCH-UHFFFAOYSA-N
N-(2-morpholinophenyl)isobutyramidine
Database identifiers
PubChem CID
15746313
Properties
Computed structural properties
XLogP
1.8
Topological polar surface area
50.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
285
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Related reactions
5 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
126234
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
1492185
As product
uspto-grants-1994_12
HRID
1492186
As product
uspto-grants-1994_12
HRID
1588594
As product
uspto-grants-1993_06
HRID
2348465
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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Compound notes
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