Basic information
- CAS
99900-84-2- Standard SMILES
O=C(CCN1CC1)NCc1ccccc1- InChIKey
XZCQFVLMFBAFFN-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- 1-Aziridinepropionamide, N-benzyl-
- IUPAC
- 3-(aziridin-1-yl)-N-benzylpropanamide
Names & synonyms
N-Benzyl-1-aziridinepropanamideN-Benzyl-1-aziridinepropionamide1-AZIRIDINEPROPIONAMIDE, N-BENZYL-99900-84-2DTXSID10244291RefChem:227738DTXCID101667823-(aziridin-1-yl)-N-benzylpropanamide
Database identifiers
- CAS
99900-84-2- PubChem CID
- 57552
- DTXSID
DTXSID10244291- Nikkaji
- J84.732A
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 32.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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