2-Cyanobutanediamide
Basic information
- CAS
18283-42-6- Standard SMILES
N#CC(CC(N)=O)C(N)=O- InChIKey
KFGCMPFWBITUSK-UHFFFAOYSA-N- Molecular formula
- C5H7N3O2
- Average molar mass
- 141.13 g/mol
- Monoisotopic mass
- 141.05382648
Names & identifiers
- Preferred name
- 2-Cyanobutanediamide
- IUPAC
- 2-cyanobutanediamide
Names & synonyms
2-cyanobutanediamide18283-42-6NSC 80748NSC80748SCHEMBL5968403DTXSID90292194CCG-40384NSC-80748AKOS006359828DS-004032
Database identifiers
- CAS
18283-42-6- PubChem CID
- 255343
- DTXSID
DTXSID90292194
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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