N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide

C14H10BrClFNO — CID 81272730

IUPACN-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide
SMILESCc1ccc(F)cc1C(=O)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C14H10BrClFNO/c1-8-2-4-10(17)7-11(8)14(19)18-13-6-9(16)3-5-12(13)15/h2-7H,1H3,(H,18,19)
InChIKeyAAZWFPVRMQABKY-UHFFFAOYSA-N
MW342.60 g/mol
LogP4.80
Rot. Bonds2

About N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide

N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide (PubChem CID 81272730) has the molecular formula C14H10BrClFNO and a molecular weight of 342.60 g/mol. Its IUPAC name is N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide
PubChem CID81272730
Molecular FormulaC14H10BrClFNO
Molecular Weight342.60 g/mol
Exact Mass340.96
IUPAC NameN-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide
SMILESCc1ccc(F)cc1C(=O)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C14H10BrClFNO/c1-8-2-4-10(17)7-11(8)14(19)18-13-6-9(16)3-5-12(13)15/h2-7H,1H3,(H,18,19)
InChIKeyAAZWFPVRMQABKY-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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Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide?
The IUPAC name of N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide (CID 81272730) is N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide.
What is the SMILES notation for N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide?
The canonical SMILES for N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide is Cc1ccc(F)cc1C(=O)Nc1cc(Cl)ccc1Br.
What is the InChIKey of N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide?
The InChIKey is AAZWFPVRMQABKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO/c1-8-2-4-10(17)7-11(8)14(19)18-13-6-9(16)3-5-12(13)15/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide?
N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide 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 N-(2-bromo-5-chlorophenyl)-5-fluoro-2-methylbenzamide is sourced from PubChem (CID 81272730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).