N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide

C13H10BrFN2O2 — CID 115298391

IUPACN-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide
SMILESNc1ccc(Br)c(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C13H10BrFN2O2/c14-10-3-2-8(16)6-11(10)17-13(19)9-5-7(15)1-4-12(9)18/h1-6,18H,16H2,(H,17,19)
InChIKeyPHPVGTMKOPLKDY-UHFFFAOYSA-N
MW325.14 g/mol
LogP3.13
Rot. Bonds2

About N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide

N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide (PubChem CID 115298391) has the molecular formula C13H10BrFN2O2 and a molecular weight of 325.14 g/mol. Its IUPAC name is N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide
PubChem CID115298391
Molecular FormulaC13H10BrFN2O2
Molecular Weight325.14 g/mol
Exact Mass323.99
IUPAC NameN-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide
SMILESNc1ccc(Br)c(NC(=O)c2cc(F)ccc2O)c1
InChIInChI=1S/C13H10BrFN2O2/c14-10-3-2-8(16)6-11(10)17-13(19)9-5-7(15)1-4-12(9)18/h1-6,18H,16H2,(H,17,19)
InChIKeyPHPVGTMKOPLKDY-UHFFFAOYSA-N
XLogP3.13
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.14
LogP ≤ 53.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298308
N-(2-amino-5-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298392
N-(4-bromo-2-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298780
3-amino-N-(2-bromo-5-fluorophenyl)-2-hydroxybenzamide
CID 107624299
N-(5-amino-2-fluorophenyl)-2-bromo-5-chlorobenzamide
CID 103805312
5-fluoro-2-[(5-fluoro-2-hydroxybenzoyl)amino]benzoic acid
CID 115298431
N-(2-carbamothioyl-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 82683463
N-(3-amino-5-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 107333935
5-amino-N-(2-bromo-5-fluorophenyl)pyridine-2-carboxamide
CID 107624285
5-fluoro-2-hydroxy-N-(2-sulfamoylphenyl)benzamide
CID 115299526
N-(2-bromo-5-fluorophenyl)-2-hydroxy-4-methylbenzamide
CID 103753405
N-(5-bromo-2-chlorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298791

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide (CID 115298391) is N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide is Nc1ccc(Br)c(NC(=O)c2cc(F)ccc2O)c1.
What is the InChIKey of N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide?
The InChIKey is PHPVGTMKOPLKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrFN2O2/c14-10-3-2-8(16)6-11(10)17-13(19)9-5-7(15)1-4-12(9)18/h1-6,18H,16H2,(H,17,19).
What are the key properties of N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide?
N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide has a molecular weight of 325.14 g/mol, XLogP of 3.13, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-bromophenyl)-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 115298391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).