N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide

C14H11BrFNO2 — CID 107676274

IUPACN-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
SMILESCc1ccc(NC(=O)c2ccc(O)cc2F)c(Br)c1
InChIInChI=1S/C14H11BrFNO2/c1-8-2-5-13(11(15)6-8)17-14(19)10-4-3-9(18)7-12(10)16/h2-7,18H,1H3,(H,17,19)
InChIKeyVGLCDJITOLKVOA-UHFFFAOYSA-N
MW324.15 g/mol
LogP3.85
Rot. Bonds2

About N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide

N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide (PubChem CID 107676274) has the molecular formula C14H11BrFNO2 and a molecular weight of 324.15 g/mol. Its IUPAC name is N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
PubChem CID107676274
Molecular FormulaC14H11BrFNO2
Molecular Weight324.15 g/mol
Exact Mass323.00
IUPAC NameN-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
SMILESCc1ccc(NC(=O)c2ccc(O)cc2F)c(Br)c1
InChIInChI=1S/C14H11BrFNO2/c1-8-2-5-13(11(15)6-8)17-14(19)10-4-3-9(18)7-12(10)16/h2-7,18H,1H3,(H,17,19)
InChIKeyVGLCDJITOLKVOA-UHFFFAOYSA-N
XLogP3.85
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.15
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 107676284
N-(2-bromo-4-chlorophenyl)-4-chloro-2-fluorobenzamide
CID 81027870
N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
N-(2-bromo-4-fluorophenyl)-4-hydroxy-2-methylbenzamide
CID 107671523
N-(5-amino-2-bromo-4-methylphenyl)-2-fluoro-4-methylbenzamide
CID 104814325
4-bromo-N-(2,4-dibromophenyl)-2-fluorobenzamide
CID 26691585
5-bromo-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674832
N-(2-bromo-5-methylphenyl)-2,4-difluorobenzamide
CID 82706445
4-bromo-N-(2-bromo-5-methylphenyl)-2-fluorobenzamide
CID 82707497
2-amino-N-(2-bromo-4-methylphenyl)-3-fluorobenzamide
CID 62649187
N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide
CID 24689737
2-bromo-N-(2-bromo-4-iodophenyl)-4-methylbenzamide
CID 114259017

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide?
The IUPAC name of N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide (CID 107676274) is N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide.
What is the SMILES notation for N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide?
The canonical SMILES for N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide is Cc1ccc(NC(=O)c2ccc(O)cc2F)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide?
The InChIKey is VGLCDJITOLKVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c1-8-2-5-13(11(15)6-8)17-14(19)10-4-3-9(18)7-12(10)16/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide?
N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide has a molecular weight of 324.15 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide is sourced from PubChem (CID 107676274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).