Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
N-(4-aminobutoxy)acetamide
HCID
140398317
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CC(=O)NOCCCCN
InChIKey
PDRSAESTNMLSRB-UHFFFAOYSA-N
Molecular formula
C6H14N2O2
Average molar mass
146.19 g/mol
Names & identifiers
Preferred name
N-(4-aminobutoxy)acetamide
IUPAC
N-(4-aminobutoxy)acetamide
Database identifiers
PubChem CID
140398317
Properties
Computed structural properties
XLogP
-0.6
Topological polar surface area
64.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
10
Formal charge
0
Complexity
95.7
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
2335740
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
Loading…