Basic information
- Standard SMILES
COc1ccc(NC(=O)NCCCOc2cccc(CN3CCCCC3)c2)cc1- InChIKey
GVKBODHQLMQIMM-UHFFFAOYSA-N- Molecular formula
- C23H31N3O3
- Average molar mass
- 397.5 g/mol
- Monoisotopic mass
- 397.23654186
Names & identifiers
- Preferred name
- N-(4-Methoxyphenyl)-N'-[3-(3-piperidinomethylphenoxy)propyl]urea
- IUPAC
- 1-(4-methoxyphenyl)-3-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]urea
Names & synonyms
CHEMBL312419SCHEMBL9513491GVKBODHQLMQIMM-UHFFFAOYSA-NN-(4-Methoxyphenyl)-N'-[3-(3-piperidinomethylphenoxy)propyl]urea
Database identifiers
- PubChem CID
- 14514731
- ChEMBL
CHEMBL312419- Nikkaji
- J499.769G
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 462
Related reactions
3 records
Compound notes
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