4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide

C14H10BrClFNO — CID 113352699

IUPAC4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide
SMILESCc1cccc(F)c1NC(=O)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C14H10BrClFNO/c1-8-3-2-4-12(17)13(8)18-14(19)9-5-6-10(15)11(16)7-9/h2-7H,1H3,(H,18,19)
InChIKeyYUORQKLCFCUSQG-UHFFFAOYSA-N
MW342.60 g/mol
LogP4.80
Rot. Bonds2

About 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide

4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide (PubChem CID 113352699) has the molecular formula C14H10BrClFNO and a molecular weight of 342.60 g/mol. Its IUPAC name is 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide
PubChem CID113352699
Molecular FormulaC14H10BrClFNO
Molecular Weight342.60 g/mol
Exact Mass340.96
IUPAC Name4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide
SMILESCc1cccc(F)c1NC(=O)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C14H10BrClFNO/c1-8-3-2-4-12(17)13(8)18-14(19)9-5-6-10(15)11(16)7-9/h2-7H,1H3,(H,18,19)
InChIKeyYUORQKLCFCUSQG-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

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Related Compounds

4-bromo-3-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 113352707
4-bromo-3-chloro-N-(2-chloro-6-methylphenyl)benzamide
CID 81002737
3-bromo-N-(2,6-dimethylphenyl)-4-fluorobenzamide
CID 103714167
N-(2-bromo-6-fluorophenyl)-3-chloro-4-hydroxybenzamide
CID 107600810
2-bromo-5-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909354
N-(2-bromo-6-fluorophenyl)-3-chloro-4-iodobenzamide
CID 107600677
N-(2-chloro-6-methylphenyl)-4-fluoro-3-sulfanylbenzamide
CID 107031792
N-(2-amino-4,6-difluorophenyl)-4-bromo-3-chlorobenzamide
CID 81313689
3-amino-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 107596191
N-(2-bromo-6-methylphenyl)-4-chlorobenzamide
CID 4100281
4-(bromomethyl)-N-(2-fluoro-6-methylphenyl)benzamide
CID 102852150
4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide
CID 81308166

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide?
The IUPAC name of 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide (CID 113352699) is 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide.
What is the SMILES notation for 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide?
The canonical SMILES for 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide is Cc1cccc(F)c1NC(=O)c1ccc(Br)c(Cl)c1.
What is the InChIKey of 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide?
The InChIKey is YUORQKLCFCUSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO/c1-8-3-2-4-12(17)13(8)18-14(19)9-5-6-10(15)11(16)7-9/h2-7H,1H3,(H,18,19).
What are the key properties of 4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide?
4-bromo-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide 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-3-chloro-N-(2-fluoro-6-methylphenyl)benzamide is sourced from PubChem (CID 113352699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).