2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide

C14H10BrF2NO2 — CID 114839990

IUPAC2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccc(F)cc2Br)ccc1F
InChIInChI=1S/C14H10BrF2NO2/c1-20-13-7-9(3-5-12(13)17)18-14(19)10-4-2-8(16)6-11(10)15/h2-7H,1H3,(H,18,19)
InChIKeySGZLRCJCPYGUEO-UHFFFAOYSA-N
MW342.14 g/mol
LogP3.99
Rot. Bonds3

About 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide

2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide (PubChem CID 114839990) has the molecular formula C14H10BrF2NO2 and a molecular weight of 342.14 g/mol. Its IUPAC name is 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide
PubChem CID114839990
Molecular FormulaC14H10BrF2NO2
Molecular Weight342.14 g/mol
Exact Mass340.99
IUPAC Name2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccc(F)cc2Br)ccc1F
InChIInChI=1S/C14H10BrF2NO2/c1-20-13-7-9(3-5-12(13)17)18-14(19)10-4-2-8(16)6-11(10)15/h2-7H,1H3,(H,18,19)
InChIKeySGZLRCJCPYGUEO-UHFFFAOYSA-N
XLogP3.99
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.14
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide 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-amino-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide
CID 114836981
2-bromo-4-fluoro-N-(4-methoxyphenyl)benzamide
CID 9191814
N-(4-bromo-3-methoxyphenyl)-4-fluoro-2-hydroxybenzamide
CID 103830086
3-bromo-2-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide
CID 106544979
2-bromo-N-(5-chloro-2-methoxyphenyl)-4-fluorobenzamide
CID 9191956
5-bromo-N-(4-fluoro-3-methoxyphenyl)-2-hydroxybenzamide
CID 105285229
2-bromo-4-chloro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 103763825
N-(4-fluoro-3-methoxyphenyl)-2-hydroxybenzamide
CID 114840033
2-bromo-4-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 103763233
5-bromo-2-chloro-N-(4-fluoro-3-methoxyphenyl)pyridine-3-carboxamide
CID 114839248
N-(4-fluoro-3-methoxyphenyl)-2-sulfanylbenzamide
CID 107036539
N-(3-bromo-4-fluorophenyl)-2,5-dimethoxybenzamide
CID 115661440

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide?
The IUPAC name of 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide (CID 114839990) is 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide.
What is the SMILES notation for 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide?
The canonical SMILES for 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide is COc1cc(NC(=O)c2ccc(F)cc2Br)ccc1F.
What is the InChIKey of 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide?
The InChIKey is SGZLRCJCPYGUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF2NO2/c1-20-13-7-9(3-5-12(13)17)18-14(19)10-4-2-8(16)6-11(10)15/h2-7H,1H3,(H,18,19).
What are the key properties of 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide?
2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide has a molecular weight of 342.14 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-fluoro-N-(4-fluoro-3-methoxyphenyl)benzamide is sourced from PubChem (CID 114839990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).