N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide

C15H13BrClFN2O — CID 107603353

IUPACN-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C15H13BrClFN2O/c1-2-19-13-7-6-9(17)8-10(13)15(21)20-14-11(16)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21)
InChIKeyXSOSSAOWUBLLDF-UHFFFAOYSA-N
MW371.64 g/mol
LogP4.93
Rot. Bonds4

About N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide

N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide (PubChem CID 107603353) has the molecular formula C15H13BrClFN2O and a molecular weight of 371.64 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide
PubChem CID107603353
Molecular FormulaC15H13BrClFN2O
Molecular Weight371.64 g/mol
Exact Mass369.99
IUPAC NameN-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C15H13BrClFN2O/c1-2-19-13-7-6-9(17)8-10(13)15(21)20-14-11(16)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21)
InChIKeyXSOSSAOWUBLLDF-UHFFFAOYSA-N
XLogP4.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.64
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
CID 62165442
2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 103765558
5-chloro-N-(2,4-difluorophenyl)-2-(ethylamino)benzamide
CID 62166930
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 62166155
5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 62166687
2-bromo-4-chloro-N-(2,6-difluorophenyl)benzamide
CID 113257211
N-(3-bromo-5-methylphenyl)-5-chloro-2-(ethylamino)benzamide
CID 107578576
5-chloro-2-(ethylamino)-N-(4-methylphenyl)benzamide
CID 62165915
N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
CID 103741269
N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
CID 107601184
N-(3-bromo-4-fluorophenyl)-2-(ethylamino)benzamide
CID 104779865

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide (CID 107603353) is N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide is CCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1Br.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide?
The InChIKey is XSOSSAOWUBLLDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClFN2O/c1-2-19-13-7-6-9(17)8-10(13)15(21)20-14-11(16)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21).
What are the key properties of N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide?
N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide has a molecular weight of 371.64 g/mol, XLogP of 4.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide is sourced from PubChem (CID 107603353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).