4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide

C15H12BrF2NO2 — CID 107735611

IUPAC4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide
SMILESCCN(C(=O)c1c(F)cc(Br)cc1F)c1cccc(O)c1
InChIInChI=1S/C15H12BrF2NO2/c1-2-19(10-4-3-5-11(20)8-10)15(21)14-12(17)6-9(16)7-13(14)18/h3-8,20H,2H2,1H3
InChIKeyLHSYRRVPBMXBNB-UHFFFAOYSA-N
MW356.17 g/mol
LogP4.10
Rot. Bonds3

About 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide

4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide (PubChem CID 107735611) has the molecular formula C15H12BrF2NO2 and a molecular weight of 356.17 g/mol. Its IUPAC name is 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide
PubChem CID107735611
Molecular FormulaC15H12BrF2NO2
Molecular Weight356.17 g/mol
Exact Mass355.00
IUPAC Name4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide
SMILESCCN(C(=O)c1c(F)cc(Br)cc1F)c1cccc(O)c1
InChIInChI=1S/C15H12BrF2NO2/c1-2-19(10-4-3-5-11(20)8-10)15(21)14-12(17)6-9(16)7-13(14)18/h3-8,20H,2H2,1H3
InChIKeyLHSYRRVPBMXBNB-UHFFFAOYSA-N
XLogP4.10
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.17
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-fluoro-N-(3-hydroxyphenyl)pyridine-4-carboxamide
CID 107856603
ethyl-(3-hydroxyphenyl)carbamic acid
CID 20544636
N-ethyl-3-hydroxy-N-(3-hydroxyphenyl)pyridine-2-carboxamide
CID 107735687
2,5-dichloro-N-ethyl-N-(3-hydroxyphenyl)benzamide
CID 107736182
2-chloro-N-ethyl-4-fluoro-N-(3-hydroxyphenyl)benzamide
CID 107736178
N-ethyl-4-hydroxy-N-(3-hydroxyphenyl)-2-methylbenzamide
CID 107735686
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678
2-amino-N-ethyl-N-(3-hydroxyphenyl)acetamide
CID 107734970
methyl N-ethyl-N-(3-hydroxyphenyl)carbamate
CID 107734186
N-ethyl-2-(2-hydroxyphenyl)-N-(3-hydroxyphenyl)acetamide
CID 107735690
N-ethyl-N-(3-hydroxyphenyl)-4-methylthiophene-3-carboxamide
CID 107736404
3-bromo-5-chloro-N-ethyl-N-(3-fluorophenyl)benzamide
CID 107952279

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide?
The IUPAC name of 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide (CID 107735611) is 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide?
The canonical SMILES for 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide is CCN(C(=O)c1c(F)cc(Br)cc1F)c1cccc(O)c1.
What is the InChIKey of 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide?
The InChIKey is LHSYRRVPBMXBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrF2NO2/c1-2-19(10-4-3-5-11(20)8-10)15(21)14-12(17)6-9(16)7-13(14)18/h3-8,20H,2H2,1H3.
What are the key properties of 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide?
4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide has a molecular weight of 356.17 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-ethyl-2,6-difluoro-N-(3-hydroxyphenyl)benzamide is sourced from PubChem (CID 107735611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).