N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide

C14H9BrClF2NO — CID 103480092

IUPACN-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide
SMILESCc1cc(C(=O)Nc2cccc(Cl)c2Br)c(F)cc1F
InChIInChI=1S/C14H9BrClF2NO/c1-7-5-8(11(18)6-10(7)17)14(20)19-12-4-2-3-9(16)13(12)15/h2-6H,1H3,(H,19,20)
InChIKeyGORMJMAQTSOOAU-UHFFFAOYSA-N
MW360.59 g/mol
LogP4.94
Rot. Bonds2

About N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide

N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide (PubChem CID 103480092) has the molecular formula C14H9BrClF2NO and a molecular weight of 360.59 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide
PubChem CID103480092
Molecular FormulaC14H9BrClF2NO
Molecular Weight360.59 g/mol
Exact Mass358.95
IUPAC NameN-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide
SMILESCc1cc(C(=O)Nc2cccc(Cl)c2Br)c(F)cc1F
InChIInChI=1S/C14H9BrClF2NO/c1-7-5-8(11(18)6-10(7)17)14(20)19-12-4-2-3-9(16)13(12)15/h2-6H,1H3,(H,19,20)
InChIKeyGORMJMAQTSOOAU-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-3-chlorophenyl)-4-fluoro-3-methylbenzamide
CID 103478813
N-(2-bromo-4-chlorophenyl)-2,4-difluoro-5-methylbenzamide
CID 115703975
2-amino-N-(2-bromo-3-chlorophenyl)-4,5-difluorobenzamide
CID 103477239
5-amino-N-(2-bromo-3-chlorophenyl)-2-methylbenzamide
CID 103477113
N-(2-bromo-3-chlorophenyl)-2,4,5-trifluoro-3-hydroxybenzamide
CID 103479739
2-amino-N-(2-bromo-3-chlorophenyl)-5-fluorobenzamide
CID 103477110
5-bromo-N-(2-bromo-3-chlorophenyl)-2-chlorobenzamide
CID 103479655
2-amino-N-(2-bromo-3-chlorophenyl)-4-fluorobenzamide
CID 103477086
3-amino-N-(2-bromo-3-chlorophenyl)-2,5-difluorobenzamide
CID 107121554
N-(2-bromo-3-chlorophenyl)-3-fluorobenzamide
CID 103479730
2-amino-3-chloro-N-(2,5-difluoro-4-methylphenyl)benzamide
CID 103584339
N-(2-bromo-3-chlorophenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 103481479

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide (CID 103480092) is N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide is Cc1cc(C(=O)Nc2cccc(Cl)c2Br)c(F)cc1F.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide?
The InChIKey is GORMJMAQTSOOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrClF2NO/c1-7-5-8(11(18)6-10(7)17)14(20)19-12-4-2-3-9(16)13(12)15/h2-6H,1H3,(H,19,20).
What are the key properties of N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide?
N-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide 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-(2-bromo-3-chlorophenyl)-2,4-difluoro-5-methylbenzamide is sourced from PubChem (CID 103480092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).