Basic information
- CAS
23280-58-2- Standard SMILES
CCN1CCC(C(=O)Nc2c(C)cccc2C)N1CC- InChIKey
DTOUMJUFIGMSKX-UHFFFAOYSA-N- Molecular formula
- C16H25N3O
- Average molar mass
- 275.39 g/mol
- Monoisotopic mass
- 275.19976243
Names & identifiers
- Preferred name
- 4-Pyrazolidinecarboxy-2',6'-xylidide, 1,2-diethyl-
- IUPAC
- N-(2,6-dimethylphenyl)-1,2-diethylpyrazolidine-3-carboxamide
Names & synonyms
23280-58-24-Pyrazolidinecarboxy-2',6'-xylidide, 1,2-diethyl-RefChem:10714891,2-Diethyl-4-pyrazolidinecarboxy-2',6'-xylidideBRN 0673804DTXSID50945972N-(2,6-Dimethylphenyl)-1,2-diethylpyrazolidine-3-carboximidic acid
Database identifiers
- CAS
23280-58-2- PubChem CID
- 211524
- DTXSID
DTXSID50945972
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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