4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide

C14H10BrClFNO — CID 103769423

IUPAC4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
SMILESCc1ccc(Cl)c(NC(=O)c2ccc(Br)cc2F)c1
InChIInChI=1S/C14H10BrClFNO/c1-8-2-5-11(16)13(6-8)18-14(19)10-4-3-9(15)7-12(10)17/h2-7H,1H3,(H,18,19)
InChIKeyQBUMGZMWPGHWKK-UHFFFAOYSA-N
MW342.60 g/mol
LogP4.80
Rot. Bonds2

About 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide

4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide (PubChem CID 103769423) has the molecular formula C14H10BrClFNO and a molecular weight of 342.60 g/mol. Its IUPAC name is 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
PubChem CID103769423
Molecular FormulaC14H10BrClFNO
Molecular Weight342.60 g/mol
Exact Mass340.96
IUPAC Name4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
SMILESCc1ccc(Cl)c(NC(=O)c2ccc(Br)cc2F)c1
InChIInChI=1S/C14H10BrClFNO/c1-8-2-5-11(16)13(6-8)18-14(19)10-4-3-9(15)7-12(10)17/h2-7H,1H3,(H,18,19)
InChIKeyQBUMGZMWPGHWKK-UHFFFAOYSA-N
XLogP4.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.60
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide 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

4-bromo-N-(2-bromo-5-methylphenyl)-2-fluorobenzamide
CID 82707497
N-(2-chloro-5-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 103733508
2-amino-N-(5-bromo-2-chlorophenyl)-5-methylbenzamide
CID 62908448
4-bromo-N-(4-chloro-2-methylphenyl)-2-fluorobenzamide
CID 24708773
3-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide
CID 106547569
4-bromo-2-fluoro-N-(3-fluoro-5-methylphenyl)benzamide
CID 79050043
4-bromo-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 47299820
N-(2-chloro-5-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 103769568
N-(5-bromo-2-chlorophenyl)-2-fluoro-3-methylbenzamide
CID 80711881
N-(3-bromo-5-methylphenyl)-2-fluoro-4-methylbenzamide
CID 107582986
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
4-bromo-N-(2,4-dibromophenyl)-2-fluorobenzamide
CID 26691585

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide?
The IUPAC name of 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide (CID 103769423) is 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide.
What is the SMILES notation for 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide?
The canonical SMILES for 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide is Cc1ccc(Cl)c(NC(=O)c2ccc(Br)cc2F)c1.
What is the InChIKey of 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide?
The InChIKey is QBUMGZMWPGHWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO/c1-8-2-5-11(16)13(6-8)18-14(19)10-4-3-9(15)7-12(10)17/h2-7H,1H3,(H,18,19).
What are the key properties of 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide?
4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide has a molecular weight of 342.60 g/mol, XLogP of 4.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2-chloro-5-methylphenyl)-2-fluorobenzamide is sourced from PubChem (CID 103769423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).