N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide

C15H12BrClFNO2 — CID 26159493

IUPACN-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide
SMILESCCOc1c(Br)cc(Cl)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C15H12BrClFNO2/c1-2-21-14-12(16)7-10(17)8-13(14)19-15(20)9-3-5-11(18)6-4-9/h3-8H,2H2,1H3,(H,19,20)
InChIKeyVORZADVHRWDGJE-UHFFFAOYSA-N
MW372.62 g/mol
LogP4.89
Rot. Bonds4

About N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide

N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide (PubChem CID 26159493) has the molecular formula C15H12BrClFNO2 and a molecular weight of 372.62 g/mol. Its IUPAC name is N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide.

Molecular Properties

Compound NameN-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide
PubChem CID26159493
Molecular FormulaC15H12BrClFNO2
Molecular Weight372.62 g/mol
Exact Mass370.97
IUPAC NameN-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide
SMILESCCOc1c(Br)cc(Cl)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C15H12BrClFNO2/c1-2-21-14-12(16)7-10(17)8-13(14)19-15(20)9-3-5-11(18)6-4-9/h3-8H,2H2,1H3,(H,19,20)
InChIKeyVORZADVHRWDGJE-UHFFFAOYSA-N
XLogP4.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.62
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-bromo-5-chloro-2-(difluoromethoxy)phenyl]-4-fluorobenzamide
CID 16613952
4-bromo-N-(3-bromo-5-chloro-2-ethoxyphenyl)-3-nitrobenzamide
CID 26159725
N-(3-bromo-5-chloro-2-ethoxyphenyl)-2-chlorobenzamide
CID 30208430
4-bromo-N-(3-bromo-5-chloro-2-ethoxyphenyl)-1H-pyrrole-2-carboxamide
CID 60710210
N-(3-bromo-5-chloro-2-ethoxyphenyl)-2-chloropyridine-3-carboxamide
CID 60710404
N-(3-bromo-5-chloro-2-ethoxyphenyl)but-2-enamide
CID 112725225
N-[3-bromo-5-chloro-2-(difluoromethoxy)phenyl]-4-(methoxymethyl)benzamide
CID 18287143
N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-(methylamino)butanamide
CID 60843123
4-amino-N-(3-bromo-5-chloro-2-methoxyphenyl)-3-fluorobenzamide
CID 63187979
2-bromo-N-(5-chloro-2-ethoxyphenyl)-4-fluorobenzamide
CID 55821778
3-bromo-4-ethoxy-N-(4-fluoro-2-methoxyphenyl)-5-methoxybenzamide
CID 86926604
2-(3-bromo-5-chloro-2-ethoxyanilino)-N-(2,6-difluorophenyl)acetamide
CID 24615139

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide?
The IUPAC name of N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide (CID 26159493) is N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide.
What is the SMILES notation for N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide?
The canonical SMILES for N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide is CCOc1c(Br)cc(Cl)cc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide?
The InChIKey is VORZADVHRWDGJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClFNO2/c1-2-21-14-12(16)7-10(17)8-13(14)19-15(20)9-3-5-11(18)6-4-9/h3-8H,2H2,1H3,(H,19,20).
What are the key properties of N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide?
N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide has a molecular weight of 372.62 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-chloro-2-ethoxyphenyl)-4-fluorobenzamide is sourced from PubChem (CID 26159493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).