Basic information
- Standard SMILES
c1cc(OCCOCCNC2CC2)cc(-c2ccsc2)c1- InChIKey
HOIHKBSQWPEMBU-UHFFFAOYSA-N- Molecular formula
- C17H21NO2S
- Average molar mass
- 303.4 g/mol
Names & identifiers
- Preferred name
- N-cyclopropyl-2-[2-[3-(3-thienyl)phenoxy]ethoxy}ethylamine
- IUPAC
- N-[2-[2-(3-thiophen-3-ylphenoxy)ethoxy]ethyl]cyclopropanamine
Names & synonyms
SCHEMBL9252018HOIHKBSQWPEMBU-UHFFFAOYSA-NN-cyclopropyl-2-[2-[3-(3-thienyl)phenoxy]ethoxy}ethylamine
Database identifiers
- PubChem CID
- 19917099
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 299
Related reactions
2 records
Compound notes
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