Basic information
- CAS
786641-12-1- Standard SMILES
CC(=O)NCC#CCN- InChIKey
QZUGFHFAXRKYCF-UHFFFAOYSA-N- Molecular formula
- C6H10N2O
- Average molar mass
- 126.16 g/mol
- Monoisotopic mass
- 126.07931295
Names & identifiers
- Preferred name
- N-(4-Aminobut-2-yn-1-yl)acetamide
- IUPAC
- N-(4-aminobut-2-ynyl)acetamide
Names & synonyms
N-(4-Aminobut-2-yn-1-yl)acetamide786641-12-1SCHEMBL17188612DTXSID20580990AKOS006350633
Database identifiers
- CAS
786641-12-1- PubChem CID
- 16005185
- DTXSID
DTXSID20580990
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 151
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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