2-bromo-N-(5-fluoro-2-methylphenyl)benzamide

C14H11BrFNO — CID 2683675

IUPAC2-bromo-N-(5-fluoro-2-methylphenyl)benzamide
SMILESCc1ccc(F)cc1NC(=O)c1ccccc1Br
InChIInChI=1S/C14H11BrFNO/c1-9-6-7-10(16)8-13(9)17-14(18)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,18)
InChIKeyRIFNMLVRGASMQC-UHFFFAOYSA-N
MW308.15 g/mol
LogP4.15
Rot. Bonds2

About 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide

2-bromo-N-(5-fluoro-2-methylphenyl)benzamide (PubChem CID 2683675) has the molecular formula C14H11BrFNO and a molecular weight of 308.15 g/mol. Its IUPAC name is 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide.

Molecular Properties

Compound Name2-bromo-N-(5-fluoro-2-methylphenyl)benzamide
PubChem CID2683675
Molecular FormulaC14H11BrFNO
Molecular Weight308.15 g/mol
Exact Mass307.00
IUPAC Name2-bromo-N-(5-fluoro-2-methylphenyl)benzamide
SMILESCc1ccc(F)cc1NC(=O)c1ccccc1Br
InChIInChI=1S/C14H11BrFNO/c1-9-6-7-10(16)8-13(9)17-14(18)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,18)
InChIKeyRIFNMLVRGASMQC-UHFFFAOYSA-N
XLogP4.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.15
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 113255067
N-(5-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
CID 7777709
5-bromo-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 65307346
2-bromo-6-fluoro-N-(5-fluoro-2-methylphenyl)benzamide
CID 115678106
2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 2446537
N-(5-fluoro-2-methylphenyl)-2-(methanesulfonamido)benzamide
CID 51163852
2-bromo-N-(5-chloro-2-methylphenyl)-4-fluorobenzamide
CID 9192644
2-bromo-N-(2-fluoro-3-methylphenyl)benzamide
CID 113351864
2-bromo-N-[1-(5-fluoro-2-methylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide
CID 134062578
3-amino-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 16784018
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
2-bromo-N-(2-carbamothioyl-4-fluorophenyl)benzamide
CID 82015339

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide?
The IUPAC name of 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide (CID 2683675) is 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide.
What is the SMILES notation for 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide?
The canonical SMILES for 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide is Cc1ccc(F)cc1NC(=O)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide?
The InChIKey is RIFNMLVRGASMQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO/c1-9-6-7-10(16)8-13(9)17-14(18)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,18).
What are the key properties of 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide?
2-bromo-N-(5-fluoro-2-methylphenyl)benzamide has a molecular weight of 308.15 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(5-fluoro-2-methylphenyl)benzamide is sourced from PubChem (CID 2683675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).