N-(3,5-dimethylphenyl)-3-(5-methylfuran-2-yl)propanamide

HCID 6489243

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Basic information

CAS: 878683-23-9
Standard SMILES: Cc1cc(C)cc(NC(=O)CCc2ccc(C)o2)c1
InChIKey: WYIMMAALTFIADT-UHFFFAOYSA-N
Molecular formula: C16H19NO2
Average molar mass: 257.33 g/mol
Monoisotopic mass: 257.14157885

Names & identifiers

Preferred name: N-(3,5-dimethylphenyl)-3-(5-methylfuran-2-yl)propanamide
IUPAC: N-(3,5-dimethylphenyl)-3-(5-methylfuran-2-yl)propanamide

Names & synonyms

N-(3,5-dimethylphenyl)-3-(5-methylfuran-2-yl)propanamide878683-23-9MLS001167955CHEMBL1548060DTXSID401328645STL023285AKOS000742823SMR000641163ST50304674F1736-0136N-(3,5-dimethylphenyl)-3-(5-methyl(2-furyl))propanamide

Database identifiers

CAS: 878683-23-9
PubChem CID: 6489243
DTXSID: DTXSID401328645
ChEMBL: CHEMBL1548060

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 42.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 19
Formal charge: 0
Complexity: 295

Experimental & physicochemical properties

Solubility34.6 [ug/mL] (The mean of the results at pH 7.4)

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