N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide

C14H9BrClF2NO — CID 103274912

IUPACN-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide
SMILESCc1cc(F)c(Br)cc1NC(=O)c1c(F)cccc1Cl
InChIInChI=1S/C14H9BrClF2NO/c1-7-5-11(18)8(15)6-12(7)19-14(20)13-9(16)3-2-4-10(13)17/h2-6H,1H3,(H,19,20)
InChIKeyJDVLNXYGWBVRNQ-UHFFFAOYSA-N
MW360.59 g/mol
LogP4.94
Rot. Bonds2

About N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide

N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide (PubChem CID 103274912) has the molecular formula C14H9BrClF2NO and a molecular weight of 360.59 g/mol. Its IUPAC name is N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide.

Molecular Properties

Compound NameN-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide
PubChem CID103274912
Molecular FormulaC14H9BrClF2NO
Molecular Weight360.59 g/mol
Exact Mass358.95
IUPAC NameN-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide
SMILESCc1cc(F)c(Br)cc1NC(=O)c1c(F)cccc1Cl
InChIInChI=1S/C14H9BrClF2NO/c1-7-5-11(18)8(15)6-12(7)19-14(20)13-9(16)3-2-4-10(13)17/h2-6H,1H3,(H,19,20)
InChIKeyJDVLNXYGWBVRNQ-UHFFFAOYSA-N
XLogP4.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.59
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-5-chloro-4-methylphenyl)-2-chloro-6-fluorobenzamide
CID 104724195
2-chloro-6-fluoro-N-(4-iodo-2-methylphenyl)benzamide
CID 47099671
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)-3-fluorobenzamide
CID 107592257
N-(5-bromo-4-fluoro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 103274644
N-(4-amino-5-chloro-2-methylphenyl)-2,6-difluorobenzamide
CID 104667512
N-(5-bromo-4-fluoro-2-methylphenyl)-4-chloropyridine-3-carboxamide
CID 103280869
2-bromo-N-(2-chloro-4-methylphenyl)-6-fluorobenzamide
CID 115678082
N-(4-amino-2,5-dimethylphenyl)-2,6-difluorobenzamide
CID 103144635
4-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)benzamide
CID 107592498
N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloropyridine-3-carboxamide
CID 103274583
N-(5-bromo-4-fluoro-2-methylphenyl)-3-chloropyridine-4-carboxamide
CID 103274622
N-(5-bromo-2-methoxyphenyl)-2-chloro-6-fluorobenzamide
CID 47317659

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide?
The IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide (CID 103274912) is N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide.
What is the SMILES notation for N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide?
The canonical SMILES for N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide is Cc1cc(F)c(Br)cc1NC(=O)c1c(F)cccc1Cl.
What is the InChIKey of N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide?
The InChIKey is JDVLNXYGWBVRNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrClF2NO/c1-7-5-11(18)8(15)6-12(7)19-14(20)13-9(16)3-2-4-10(13)17/h2-6H,1H3,(H,19,20).
What are the key properties of N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide?
N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide has a molecular weight of 360.59 g/mol, XLogP of 4.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloro-6-fluorobenzamide is sourced from PubChem (CID 103274912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).