Basic information
- CAS
39965-29-2- Standard SMILES
O=C(CCc1ccc([N+](=O)[O-])o1)NC1CCCCC1- InChIKey
HAKWQWVHDYQMBY-UHFFFAOYSA-N- Molecular formula
- C13H18N2O4
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.12665706
Names & identifiers
- Preferred name
- N-Cyclohexyl-5-nitro-2-furanpropanamide
- IUPAC
- N-cyclohexyl-3-(5-nitrofuran-2-yl)propanamide
- English name
- N-Cyclohexyl-5-nitro-2-furanpropanamide
- Molecular weight
- 0
Names & synonyms
CnpnaN-Cyclohexyl-5-nitro-2-furanpropanamide39965-29-2N-cyclohexyl-3-(5-nitrofuran-2-yl)propanamide2-FURANPROPANAMIDE, N-CYCLOHEXYL-5-NITRO-BE95T3Z39ABRN 1321385UNII-BE95T3Z39ASCHEMBL30362905DTXSID60193003CYCLOHEXYL-5-NITRO-2-FURANPROPANAMIDE, N-
Database identifiers
- CAS
39965-29-2- PubChem CID
- 38372
- DTXSID
DTXSID60193003- UNII
- BE95T3Z39A
- Nikkaji
- J1.041C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Physicochemical properties
- FDA UNII
- 95 T3Z39A · BE95T3Z39A
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…