N-Methyl-2-butynamide
Basic information
- CAS
63798-30-1- Standard SMILES
CC#CC(=O)NC- InChIKey
NFKDOZIFRBUOCG-UHFFFAOYSA-N- Molecular formula
- C5H7NO
- Average molar mass
- 97.12 g/mol
- Monoisotopic mass
- 97.05276385
Names & identifiers
- Preferred name
- N-Methyl-2-butynamide
- IUPAC
- N-methylbut-2-ynamide
Names & synonyms
N-Methyl-2-butynamide2-Butynamide, N-methyl-63798-30-1N-Methyl-2-butynamide #SCHEMBL761961SCHEMBL6965627CHEMBL3352947NFKDOZIFRBUOCG-UHFFFAOYSA-NDTXSID501337546AKOS006359094
Database identifiers
- CAS
63798-30-1- PubChem CID
- 549138
- DTXSID
DTXSID501337546- ChEMBL
CHEMBL3352947
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 126
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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