Basic information
- CAS
1252362-54-1- Standard SMILES
CCN(C(=O)NCc1ccc(OCC(=O)N(C)C)c(OC)c1)C1CCCCC1- InChIKey
AJDJLERLYJYGAU-UHFFFAOYSA-N- Molecular formula
- C21H33N3O4
- Average molar mass
- 391.5 g/mol
- Monoisotopic mass
- 391.24710654
Names & identifiers
- Preferred name
- 2-[4-({[cyclohexyl(ethyl)carbamoyl]amino}methyl)-2-methoxyphenoxy]-N,N-dimethylacetamide
- IUPAC
- 2-[4-[[[cyclohexyl(ethyl)carbamoyl]amino]methyl]-2-methoxyphenoxy]-N,N-dimethylacetamide
Names & synonyms
DTXSID601117682AKOS0344485821252362-54-1Acetamide, 2-[4-[[[(cyclohexylethylamino)carbonyl]amino]methyl]-2-methoxyphenoxy]-N,N-dimethyl-Z5592059322-[4-({[cyclohexyl(ethyl)carbamoyl]amino}methyl)-2-methoxyphenoxy]-N,N-dimethylacetamide
Database identifiers
- CAS
1252362-54-1- PubChem CID
- 51118294
- DTXSID
DTXSID601117682
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 494
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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