Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide (HCID 19907192)|Huagongshe
Home
/
Compound
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
HCID
19907192
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CN(C)C(=O)C1CC(O)CN1
InChIKey
ZOHZTBXVKULCNB-UHFFFAOYSA-N
Molecular formula
C7H14N2O2
Average molar mass
158.2 g/mol
Names & identifiers
Preferred name
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
IUPAC
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
Names & synonyms
SCHEMBL30537960
Database identifiers
PubChem CID
19907192
Properties
Computed structural properties
XLogP
-1.1
Topological polar surface area
52.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
159
Show all 8
Show all 8 / 8
Related reactions
14 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
87194
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
93160
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
115175
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
176631
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
179954
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
817101
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
818980
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
956743
As product
Validation data from https://doi.org/10.1039/C8SC04228D
Show 4 more
Page 1 of 2
Next
Compound notes
Loading…