3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide

C13H8F3NO3 — CID 107703907

IUPAC3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide
SMILESO=C(Nc1cc(F)cc(F)c1F)c1cc(O)cc(O)c1
InChIInChI=1S/C13H8F3NO3/c14-7-3-10(15)12(16)11(4-7)17-13(20)6-1-8(18)5-9(19)2-6/h1-5,18-19H,(H,17,20)
InChIKeyDMXFILLGAVWUOZ-UHFFFAOYSA-N
MW283.20 g/mol
LogP2.77
Rot. Bonds2

About 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide

3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide (PubChem CID 107703907) has the molecular formula C13H8F3NO3 and a molecular weight of 283.20 g/mol. Its IUPAC name is 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide.

Molecular Properties

Compound Name3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide
PubChem CID107703907
Molecular FormulaC13H8F3NO3
Molecular Weight283.20 g/mol
Exact Mass283.05
IUPAC Name3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide
SMILESO=C(Nc1cc(F)cc(F)c1F)c1cc(O)cc(O)c1
InChIInChI=1S/C13H8F3NO3/c14-7-3-10(15)12(16)11(4-7)17-13(20)6-1-8(18)5-9(19)2-6/h1-5,18-19H,(H,17,20)
InChIKeyDMXFILLGAVWUOZ-UHFFFAOYSA-N
XLogP2.77
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)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-(2,4-difluorophenyl)-3,5-dihydroxybenzamide
CID 103891425
3-hydroxy-4-methoxy-N-(2,3,5-trifluorophenyl)benzamide
CID 79735123
N-(2,5-difluoro-4-methylphenyl)-3,5-dihydroxybenzamide
CID 107704386
N-(4-bromo-5-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 104889817
N-(4-fluoro-2-methylphenyl)-3,5-dihydroxybenzamide
CID 103891547
5-chloro-2-hydroxy-N-(2,3,5-trifluorophenyl)benzamide
CID 62813735
N-(4-fluorophenyl)-3,5-dihydroxybenzamide
CID 103891338
2-hydroxy-4-methoxy-N-(2,3,5-trifluorophenyl)benzamide
CID 62813403
4-bromo-2-hydroxy-N-(2,3,5-trifluorophenyl)benzamide
CID 62813902
2-[(3,5-dihydroxybenzoyl)amino]-6-fluorobenzoic acid
CID 107702397
3-fluoro-2-(methylamino)-N-(2,3,5-trifluorophenyl)pyridine-4-carboxamide
CID 105386062
2,3-difluoro-N-(2,3,5-trifluorophenyl)pyridine-4-carboxamide
CID 105381162

Frequently Asked Questions

What is the IUPAC name of 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide?
The IUPAC name of 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide (CID 107703907) is 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide.
What is the SMILES notation for 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide?
The canonical SMILES for 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide is O=C(Nc1cc(F)cc(F)c1F)c1cc(O)cc(O)c1.
What is the InChIKey of 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide?
The InChIKey is DMXFILLGAVWUOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F3NO3/c14-7-3-10(15)12(16)11(4-7)17-13(20)6-1-8(18)5-9(19)2-6/h1-5,18-19H,(H,17,20).
What are the key properties of 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide?
3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide has a molecular weight of 283.20 g/mol, XLogP of 2.77, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydroxy-N-(2,3,5-trifluorophenyl)benzamide is sourced from PubChem (CID 107703907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).