N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide

C15H13BrFNO3 — CID 103278127

IUPACN-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cc(Br)c(F)cc2C)c1O
InChIInChI=1S/C15H13BrFNO3/c1-8-6-11(17)10(16)7-12(8)18-15(20)9-4-3-5-13(21-2)14(9)19/h3-7,19H,1-2H3,(H,18,20)
InChIKeySOEOBUSPUVWXKZ-UHFFFAOYSA-N
MW354.18 g/mol
LogP3.86
Rot. Bonds3

About N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide

N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide (PubChem CID 103278127) has the molecular formula C15H13BrFNO3 and a molecular weight of 354.18 g/mol. Its IUPAC name is N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide
PubChem CID103278127
Molecular FormulaC15H13BrFNO3
Molecular Weight354.18 g/mol
Exact Mass353.01
IUPAC NameN-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cc(Br)c(F)cc2C)c1O
InChIInChI=1S/C15H13BrFNO3/c1-8-6-11(17)10(16)7-12(8)18-15(20)9-4-3-5-13(21-2)14(9)19/h3-7,19H,1-2H3,(H,18,20)
InChIKeySOEOBUSPUVWXKZ-UHFFFAOYSA-N
XLogP3.86
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.18
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-4-methylphenyl)-2-hydroxy-3-methoxybenzamide
CID 24703596
2-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 103274988
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)-3-fluorobenzamide
CID 107592257
N-(5-bromo-4-fluoro-2-methylphenyl)-3-methoxy-4-methylbenzamide
CID 103274645
2-amino-N-(5-bromo-2,4-difluorophenyl)-3-methoxybenzamide
CID 102852353
N-(4-bromo-2,3-dichlorophenyl)-2-hydroxy-3-methoxybenzamide
CID 107791061
N-(2,5-dichloro-4-methylphenyl)-2-hydroxy-3-methoxybenzamide
CID 115761010
N-(3-fluoro-4-pyridinyl)-2-hydroxy-3-methoxybenzamide
CID 103874422
1-(5-bromo-4-fluoro-2-methylphenyl)-3-(3-methoxyphenyl)urea
CID 103269220
N-(5-bromo-4-fluoro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 103274644
N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloropyridine-3-carboxamide
CID 103274583
2-hydroxy-3-methoxy-N-(2,4,5-trichlorophenyl)benzamide
CID 29286272

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide?
The IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide (CID 103278127) is N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)Nc2cc(Br)c(F)cc2C)c1O.
What is the InChIKey of N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide?
The InChIKey is SOEOBUSPUVWXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO3/c1-8-6-11(17)10(16)7-12(8)18-15(20)9-4-3-5-13(21-2)14(9)19/h3-7,19H,1-2H3,(H,18,20).
What are the key properties of N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide?
N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide has a molecular weight of 354.18 g/mol, XLogP of 3.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-fluoro-2-methylphenyl)-2-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 103278127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).