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

C15H13BrFNO2 — CID 2446537

IUPAC2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2cc(F)ccc2C)c1
InChIInChI=1S/C15H13BrFNO2/c1-9-3-4-10(17)7-14(9)18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,1-2H3,(H,18,19)
InChIKeyCTYYUHSDWHQAAO-UHFFFAOYSA-N
MW338.18 g/mol
LogP4.16
Rot. Bonds3

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

2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide (PubChem CID 2446537) has the molecular formula C15H13BrFNO2 and a molecular weight of 338.18 g/mol. Its IUPAC name is 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide.

Molecular Properties

Compound Name2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
PubChem CID2446537
Molecular FormulaC15H13BrFNO2
Molecular Weight338.18 g/mol
Exact Mass337.01
IUPAC Name2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2cc(F)ccc2C)c1
InChIInChI=1S/C15H13BrFNO2/c1-9-3-4-10(17)7-14(9)18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,1-2H3,(H,18,19)
InChIKeyCTYYUHSDWHQAAO-UHFFFAOYSA-N
XLogP4.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.18
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 103274988
2-bromo-N-(5-fluoro-2-methylphenyl)benzamide
CID 2683675
2-amino-N-(2-bromo-4-fluorophenyl)-5-methoxybenzamide
CID 60954882
2-bromo-N-(5-fluoro-2-pyridinyl)-5-methoxybenzamide
CID 62877597
2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
CID 64793819
5-bromo-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 65307346
2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide
CID 103909645
2-bromo-5-methoxy-N-(8-methylquinolin-5-yl)benzamide
CID 38266685
N-(3-amino-2,6-dimethylphenyl)-2-bromo-5-methoxybenzamide
CID 24703033
1-(5-fluoro-2-methylphenyl)-3-(4-methoxyphenyl)urea
CID 970666
2,5-dibromo-N-(4-fluoro-2-methylphenyl)benzamide
CID 114370000
2-bromo-N-(5-bromo-2-chlorophenyl)-5-methoxybenzamide
CID 62908603

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide?
The IUPAC name of 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide (CID 2446537) is 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide.
What is the SMILES notation for 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide?
The canonical SMILES for 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide is COc1ccc(Br)c(C(=O)Nc2cc(F)ccc2C)c1.
What is the InChIKey of 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide?
The InChIKey is CTYYUHSDWHQAAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO2/c1-9-3-4-10(17)7-14(9)18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,1-2H3,(H,18,19).
What are the key properties of 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide?
2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide has a molecular weight of 338.18 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide is sourced from PubChem (CID 2446537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).