N-(2-methylphenyl)-N-[1-(prop-2-en-1-yl)cyclohexyl]acetamide
Basic information
- CAS
5799-77-9- Standard SMILES
C=CCC1(N(C(C)=O)c2ccccc2C)CCCCC1- InChIKey
SXEMYFNNTVFZCZ-UHFFFAOYSA-N- Molecular formula
- C18H25NO
- Average molar mass
- 271.4 g/mol
- Monoisotopic mass
- 271.19361442
Names & identifiers
- Preferred name
- N-(2-methylphenyl)-N-[1-(prop-2-en-1-yl)cyclohexyl]acetamide
- IUPAC
- N-(2-methylphenyl)-N-(1-prop-2-enylcyclohexyl)acetamide
Names & synonyms
5799-77-9N-(2-methylphenyl)-N-[1-(prop-2-en-1-yl)cyclohexyl]acetamideN-(1-allylcyclohexyl)-N-(2-methylphenyl)acetamideCBMicro_049321MLS000711028CHEMBL1612057DTXSID80973561N-(2-methylphenyl)-N-(1-prop-2-enylcyclohexyl)acetamideSTK376401AKOS000567550SMR000280795ST100667
Show more names
BIM-0049311.P001
Database identifiers
- CAS
5799-77-9- PubChem CID
- 780930
- DTXSID
DTXSID80973561- ChEMBL
CHEMBL1612057
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
Experimental & physicochemical properties
Solubility6.7 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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