Basic information
- CAS
5939-06-0- Standard SMILES
CCCN(Cc1cccn1Cc1cccc(F)c1)C(=O)C(C)(C)C- InChIKey
NQGQVAMHPXJHGZ-UHFFFAOYSA-N- Molecular formula
- C20H27FN2O
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.21074165
Names & identifiers
- Preferred name
- N-({1-[(3-Fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2,2-dimethyl-N-propylpropanamide
- IUPAC
- N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2,2-dimethyl-N-propylpropanamide
Names & synonyms
5939-06-0DTXSID50355633N-({1-[(3-Fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2,2-dimethyl-N-propylpropanamide
Database identifiers
- CAS
5939-06-0- PubChem CID
- 810403
- DTXSID
DTXSID50355633
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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