N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide

C9H10FNO3 — CID 89255342

IUPACN-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)c(O)c(C)c1O
InChIInChI=1S/C9H10FNO3/c1-4-8(13)6(10)3-7(9(4)14)11-5(2)12/h3,13-14H,1-2H3,(H,11,12)
InChIKeyIEMSGMPZGPKEMF-UHFFFAOYSA-N
MW199.18 g/mol
LogP1.50
Rot. Bonds1

About N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide

N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide (PubChem CID 89255342) has the molecular formula C9H10FNO3 and a molecular weight of 199.18 g/mol. Its IUPAC name is N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide
PubChem CID89255342
Molecular FormulaC9H10FNO3
Molecular Weight199.18 g/mol
Exact Mass199.06
IUPAC NameN-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)c(O)c(C)c1O
InChIInChI=1S/C9H10FNO3/c1-4-8(13)6(10)3-7(9(4)14)11-5(2)12/h3,13-14H,1-2H3,(H,11,12)
InChIKeyIEMSGMPZGPKEMF-UHFFFAOYSA-N
XLogP1.50
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.18
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamido-2,5-difluorophenyl)acetamide
CID 176892585
N-(3,4-difluoro-2-methylphenyl)acetamide
CID 15692403
N-(3-bromo-2-hydroxy-5-methylphenyl)acetamide
CID 126991929
N-(2,3,4,5-tetramethylphenyl)acetamide
CID 54490294
N-[2,5-difluoro-4-(trifluoromethyl)phenyl]acetamide
CID 14148742
N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide
CID 20553706
(2S)-N-(2-acetamido-4,5-difluorophenyl)-2-aminopropanamide
CID 119308430
N-(2-acetamido-4,5-difluorophenyl)-3,5-difluorobenzamide
CID 51106132
N-[4-[3-(4-acetamido-3-fluorophenyl)-2-hydroxyphenyl]-2-fluorophenyl]acetamide
CID 166166783
methyl 4-acetamido-2,3,6-trifluorobenzoate
CID 162354663
N-(3,4-difluoro-5-methoxy-2-methylphenyl)acetamide;ethane
CID 178095697
N-(4-chloro-2-fluorophenyl)acetamide;hydrochloride
CID 142696618

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide?
The IUPAC name of N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide (CID 89255342) is N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide.
What is the SMILES notation for N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide?
The canonical SMILES for N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide is CC(=O)Nc1cc(F)c(O)c(C)c1O.
What is the InChIKey of N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide?
The InChIKey is IEMSGMPZGPKEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO3/c1-4-8(13)6(10)3-7(9(4)14)11-5(2)12/h3,13-14H,1-2H3,(H,11,12).
What are the key properties of N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide?
N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide has a molecular weight of 199.18 g/mol, XLogP of 1.50, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2,4-dihydroxy-3-methylphenyl)acetamide is sourced from PubChem (CID 89255342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).