1-Acetyl-2-pyrrolidinecarboxamide
Basic information
- CAS
30130-35-9- Standard SMILES
CC(=O)N1CCCC1C(N)=O- InChIKey
CXURPNUIYCJENH-UHFFFAOYSA-N- Molecular formula
- C7H12N2O2
- Average molar mass
- 156.18 g/mol
- Monoisotopic mass
- 156.08987763
Names & identifiers
- Preferred name
- 1-Acetyl-2-pyrrolidinecarboxamide
- IUPAC
- 1-acetylpyrrolidine-2-carboxamide
- English name
- 2-Pyrrolidinecarboxamide,1-acetyl-(6CI,9CI)
- Molecular formula
- C7H12N2O2
- Molecular weight
- 156.18
Names & synonyms
1-Acetyl-2-pyrrolidinecarboxamide30130-35-91-acetylpyrrolidine-2-carboxamideAc-Pro-NH1-Acetylprolinamide2-Pyrrolidinecarboxamide,1-acetyl-(6CI,9CI)MFCD03939870Acetyl-L-proline amiden-acetyl-dl-prolinamideSCHEMBL425457SCHEMBL642427SCHEMBL2346750
Show more names
2-Pyrrolidinecarboxamide, 1-acetyl-
SCHEMBL9772341DTXSID00310818NSC231951AKOS009029789NSC-231951SB46705BS-25271DB-043577
Database identifiers
- CAS
30130-35-9- PubChem CID
- 314477
- DTXSID
DTXSID00310818
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 191
Physicochemical properties
- Boiling point
- 411.925 · 411.925±34.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.207 · 1.207±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 15.41 · 15.410±0.20(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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