4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide

C14H12FNO3 — CID 103889353

IUPAC4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide
SMILESCc1cc(O)ccc1NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H12FNO3/c1-8-6-10(17)3-5-12(8)16-14(19)11-4-2-9(15)7-13(11)18/h2-7,17-18H,1H3,(H,16,19)
InChIKeyJZZZWAZUSSECOG-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.80
Rot. Bonds2

About 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide

4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide (PubChem CID 103889353) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide
PubChem CID103889353
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC Name4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide
SMILESCc1cc(O)ccc1NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H12FNO3/c1-8-6-10(17)3-5-12(8)16-14(19)11-4-2-9(15)7-13(11)18/h2-7,17-18H,1H3,(H,16,19)
InChIKeyJZZZWAZUSSECOG-UHFFFAOYSA-N
XLogP2.80
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromo-4-fluorophenyl)-4-hydroxy-2-methylbenzamide
CID 107671523
N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
CID 103887364
2,4-dihydroxy-N-[2-methyl-4-(methylamino)phenyl]benzamide
CID 143020352
2-fluoro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 1234575
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
2-chloro-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 6468797
2-bromo-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 9192994
2-chloro-5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 114034241
N-(4-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 103891547
N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
2,4-dichloro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 849254
N-(2-chloro-6-methylphenyl)-4-fluoro-2-hydroxybenzamide
CID 103889268

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide (CID 103889353) is 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide is Cc1cc(O)ccc1NC(=O)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide?
The InChIKey is JZZZWAZUSSECOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-8-6-10(17)3-5-12(8)16-14(19)11-4-2-9(15)7-13(11)18/h2-7,17-18H,1H3,(H,16,19).
What are the key properties of 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide?
4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide has a molecular weight of 261.25 g/mol, XLogP of 2.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide is sourced from PubChem (CID 103889353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).