Basic information
- Standard SMILES
Ic1ccc(C2(CN3CCCC3)CC2)cc1- InChIKey
PQVBVUWZSMJDCI-UHFFFAOYSA-N- Molecular formula
- C14H18IN
- Average molar mass
- 327.2 g/mol
- Monoisotopic mass
- 327.0484
Names & identifiers
- Preferred name
- 1-{[1-(4-Iodophenyl)cyclopropyl]methyl}pyrrolidine
- IUPAC
- 1-[[1-(4-iodophenyl)cyclopropyl]methyl]pyrrolidine
Names & synonyms
SCHEMBL5645130PQVBVUWZSMJDCI-UHFFFAOYSA-N1-{[1-(4-iodophenyl)cyclopropyl]methyl}pyrrolidine
Database identifiers
- PubChem CID
- 69517232
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 235
Related reactions
1 records
Compound notes
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