Basic information
- CAS
23105-58-0- Standard SMILES
CC(=O)N1C=CCC1- InChIKey
CMFWLOPIOWBYCM-UHFFFAOYSA-N- Molecular formula
- C6H9NO
- Average molar mass
- 111.14 g/mol
- Monoisotopic mass
- 111.06841391
Overview
N-Acetyl-2,3-dihydro-1H-pyrrole is a pyrroline.
Names & identifiers
- Preferred name
- N-Acetyl-2-pyrroline
- IUPAC
- 1-(2,3-dihydropyrrol-1-yl)ethanone
Names & synonyms
N-acetyl-2-pyrroline23105-58-0DTXSID201315232RefChem:1091506DTXCID501745135N-Acetyl-2,3-dihydro-1H-pyrrole1-(2,3-dihydropyrrol-1-yl)ethanone1-(2,3-dihydro-1H-pyrrol-1-yl)ethan-1-oneacetylpyrroline1-acetyl-2,3-dihydro-1H-pyrroleSCHEMBL310712SCHEMBL7831444
Show more names
CHEBI:179310CMFWLOPIOWBYCM-UHFFFAOYSA-N1-(2,3-dihydro-1H-pyrrol-1-yl)-ethanoneEthanone, 1-(2,3-dihydro-1H-pyrrol-1-yl)-
Database identifiers
- CAS
23105-58-0- PubChem CID
- 10909522
- DTXSID
DTXSID201315232- ChEBI
CHEBI:179310- Nikkaji
- J452.590F
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 128
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Related reactions
14 records
Compound notes
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