N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide

C13H9F2NO3 — CID 114344008

IUPACN-(2,3-difluorophenyl)-2,3-dihydroxybenzamide
SMILESO=C(Nc1cccc(F)c1F)c1cccc(O)c1O
InChIInChI=1S/C13H9F2NO3/c14-8-4-2-5-9(11(8)15)16-13(19)7-3-1-6-10(17)12(7)18/h1-6,17-18H,(H,16,19)
InChIKeyBOSPSAXNXVVQES-UHFFFAOYSA-N
MW265.21 g/mol
LogP2.63
Rot. Bonds2

About N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide

N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide (PubChem CID 114344008) has the molecular formula C13H9F2NO3 and a molecular weight of 265.21 g/mol. Its IUPAC name is N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide.

Molecular Properties

Compound NameN-(2,3-difluorophenyl)-2,3-dihydroxybenzamide
PubChem CID114344008
Molecular FormulaC13H9F2NO3
Molecular Weight265.21 g/mol
Exact Mass265.06
IUPAC NameN-(2,3-difluorophenyl)-2,3-dihydroxybenzamide
SMILESO=C(Nc1cccc(F)c1F)c1cccc(O)c1O
InChIInChI=1S/C13H9F2NO3/c14-8-4-2-5-9(11(8)15)16-13(19)7-3-1-6-10(17)12(7)18/h1-6,17-18H,(H,16,19)
InChIKeyBOSPSAXNXVVQES-UHFFFAOYSA-N
XLogP2.63
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.21
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-(2,3-difluorophenyl)-4-fluoro-2-hydroxybenzamide
CID 103888089
N-(2-carbamothioyl-3-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343600
2-amino-N-(2,3-difluorophenyl)-3-methylbenzamide
CID 61074628
N-(5-bromo-2-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343963
3-amino-2-chloro-N-(2,3-difluorophenyl)benzamide
CID 112575125
N-(4-amino-2-fluorophenyl)-2,3-dihydroxybenzamide
CID 114343189
N-(2-ethylphenyl)-2,3-difluorobenzamide
CID 62650811
2-amino-4-chloro-N-(2,3-difluorophenyl)benzamide
CID 61074997
N-(2,3-difluorophenyl)benzamide
CID 139202270
3-[(2-fluorobenzoyl)amino]-2-hydroxybenzoic acid
CID 104832806
2-amino-3-fluoro-N-(2,3,4-trifluorophenyl)benzamide
CID 62649534
2-[(2,3-difluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 63615588

Frequently Asked Questions

What is the IUPAC name of N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide?
The IUPAC name of N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide (CID 114344008) is N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide.
What is the SMILES notation for N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide?
The canonical SMILES for N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide is O=C(Nc1cccc(F)c1F)c1cccc(O)c1O.
What is the InChIKey of N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide?
The InChIKey is BOSPSAXNXVVQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2NO3/c14-8-4-2-5-9(11(8)15)16-13(19)7-3-1-6-10(17)12(7)18/h1-6,17-18H,(H,16,19).
What are the key properties of N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide?
N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide has a molecular weight of 265.21 g/mol, XLogP of 2.63, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide is sourced from PubChem (CID 114344008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).