N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide

C16H16N2O4 — CID 57096250

IUPACN-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide
SMILESCC(=O)Nc1ccc(O)cc1N(C(C)=O)c1ccccc1O
InChIInChI=1S/C16H16N2O4/c1-10(19)17-13-8-7-12(21)9-15(13)18(11(2)20)14-5-3-4-6-16(14)22/h3-9,21-22H,1-2H3,(H,17,19)
InChIKeyNAITWSLTPIGLQM-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.74
Rot. Bonds3

About N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide

N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide (PubChem CID 57096250) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide
PubChem CID57096250
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC NameN-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide
SMILESCC(=O)Nc1ccc(O)cc1N(C(C)=O)c1ccccc1O
InChIInChI=1S/C16H16N2O4/c1-10(19)17-13-8-7-12(21)9-15(13)18(11(2)20)14-5-3-4-6-16(14)22/h3-9,21-22H,1-2H3,(H,17,19)
InChIKeyNAITWSLTPIGLQM-UHFFFAOYSA-N
XLogP2.74
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(2,5-Dihydroxyphenyl)acetamide
CID 6433002
2-(cyclohexylamino)-N-(2,5-dihydroxyphenyl)acetamide
CID 77460995
N-(2,5-dihydroxyphenyl)-2-(N-methylanilino)acetamide
CID 118722092
2-[cyclohexyl(methyl)amino]-N-(2,5-dihydroxyphenyl)acetamide
CID 118722100
N1-(2-aminophenyl)-N7-(3-hydroxyphenyl)heptanediamide
CID 78319017
(2-Amino-6-hydroxyphenyl)urea
CID 18006547
N-(2-hydroxyphenyl)-2-(N-methylanilino)acetamide
CID 48418800
N-(3-hydroxyphenyl)-2-(N-methylanilino)acetamide
CID 118722094
2-anilino-N-(2,5-dihydroxyphenyl)acetamide
CID 118722096
N-(2,5-dihydroxyphenyl)-2-[methyl(propyl)amino]acetamide
CID 118722099
Ethanediamide, N-(2-hydroxyphenyl)-N'-(4-hydroxyphenyl)-
CID 210210
5-methyl-10H-phenazin-1-ol
CID 439562

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide?
The IUPAC name of N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide (CID 57096250) is N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide.
What is the SMILES notation for N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide?
The canonical SMILES for N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide is CC(=O)Nc1ccc(O)cc1N(C(C)=O)c1ccccc1O.
What is the InChIKey of N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide?
The InChIKey is NAITWSLTPIGLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c1-10(19)17-13-8-7-12(21)9-15(13)18(11(2)20)14-5-3-4-6-16(14)22/h3-9,21-22H,1-2H3,(H,17,19).
What are the key properties of N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide?
N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide has a molecular weight of 300.31 g/mol, XLogP of 2.74, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2-hydroxyanilino)-4-hydroxyphenyl]acetamide is sourced from PubChem (CID 57096250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).