Hydrocinnamamide, alpha-(benzoylamino)-4-(2-(diethylamino)ethoxy)-, (+-)-

HCID 64895

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Basic information

CAS: 57227-34-6
Standard SMILES: CCN(CC)CCOc1ccc(CC(NC(=O)c2ccccc2)C(N)=O)cc1
InChIKey: PCIUIOOWSCCVDJ-UHFFFAOYSA-N
Molecular formula: C22H29N3O3
Average molar mass: 383.5 g/mol
Monoisotopic mass: 383.2208918

Names & identifiers

Preferred name: Hydrocinnamamide, alpha-(benzoylamino)-4-(2-(diethylamino)ethoxy)-, (+-)-
IUPAC: N-[1-amino-3-[4-[2-(diethylamino)ethoxy]phenyl]-1-oxopropan-2-yl]benzamide

Names & synonyms

CR 740BRN 4003906O-(2-Diethylaminoethyl)-N-benzoyl-DL-tyrosyl-amide57227-34-6(+-)-alpha-(Benzoylamino)-4-(2-(diethylamino)ethoxy)hydrocinnamamideHydrocinnamamide, alpha-(benzoylamino)-4-(2-(diethylamino)ethoxy)-, (+-)-RefChem:348269SCHEMBL11826987DTXSID70972689N-(3-{4-[2-(Diethylamino)ethoxy]phenyl}-1-hydroxy-1-iminopropan-2-yl)benzenecarboximidic acid

Database identifiers

CAS: 57227-34-6
PubChem CID: 64895
DTXSID: DTXSID70972689

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 84.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 11
Heavy atoms: 28
Formal charge: 0
Complexity: 468

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