4-(2-Aminoethyl)phenol; N-(4-Methyl-2-oxopentanoyl) 

AlkaPlorer ID: AK285451

Synonym: N-[2-(4-Hydroxyphenyl)ethyl]-4-methyl-2-oxopentanamide, N-(4-Methyl-2-oxopentanoyl)tyramine 

IUPAC Name: N-[2-(4-hydroxyphenyl)ethyl]-4-methyl-2-oxopentanamide

Structure

SMILES: CC(C)CC(=O)C(=O)NCCC1=CC=C(O)C=C1

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InChI: InChI=1S/C14H19NO3/c1-10(2)9-13(17)14(18)15-8-7-11-3-5-12(16)6-4-11/h3-6,10,16H,7-9H2,1-2H3,(H,15,18)

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InChIKey: CLWPYVSFIMQULH-UHFFFAOYSA-N

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Reference

PubChem CID: 45378308

CAS: 1209463-11-5

Properties Information

Molecule Weight: 249.31

TPSA: 66.4

MolLogP: 1.6661

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information