2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide

C20H17NO4 — CID 113199162

IUPAC2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)c(O)c1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C20H17NO4/c22-17-11-10-14(12-18(17)23)13-20(24)21-16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-12,22-23H,13H2,(H,21,24)
InChIKeyLOBXDABETBIFSO-UHFFFAOYSA-N
MW335.36 g/mol
LogP4.07
Rot. Bonds5

About 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide

2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide (PubChem CID 113199162) has the molecular formula C20H17NO4 and a molecular weight of 335.36 g/mol. Its IUPAC name is 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide
PubChem CID113199162
Molecular FormulaC20H17NO4
Molecular Weight335.36 g/mol
Exact Mass335.12
IUPAC Name2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)c(O)c1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C20H17NO4/c22-17-11-10-14(12-18(17)23)13-20(24)21-16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-12,22-23H,13H2,(H,21,24)
InChIKeyLOBXDABETBIFSO-UHFFFAOYSA-N
XLogP4.07
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 54.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
3,4-dihydroxy-N-(2-phenoxyphenyl)benzamide
CID 113199337
N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide
CID 78838328
2-(1,3-oxazol-4-yl)-N-(2-phenoxyphenyl)acetamide
CID 110686412
N-(2,3-dichlorophenyl)-2-(3,4-dihydroxyphenyl)acetamide
CID 113199172
2-[(2-phenoxyanilino)methyl]phenol
CID 43823583
2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
CID 108998186
2-(4-ethylanilino)-N-(2-phenoxyphenyl)acetamide
CID 109007685
N-(2-methoxyphenyl)-2-(2-phenoxyanilino)acetamide
CID 7922855
5-bromo-2-hydroxy-N-(2-phenoxyphenyl)benzamide
CID 20604832
3-(4-ethylphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 108795900
N-(2-phenoxyphenyl)decanamide
CID 4091110

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide (CID 113199162) is 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide is O=C(Cc1ccc(O)c(O)c1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide?
The InChIKey is LOBXDABETBIFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO4/c22-17-11-10-14(12-18(17)23)13-20(24)21-16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-12,22-23H,13H2,(H,21,24).
What are the key properties of 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide?
2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide has a molecular weight of 335.36 g/mol, XLogP of 4.07, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydroxyphenyl)-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 113199162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).