N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide

C14H10BrF2NO2 — CID 103756076

IUPACN-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1cc(F)ccc1Br
InChIInChI=1S/C14H10BrF2NO2/c1-20-12-4-2-3-10(17)13(12)14(19)18-11-7-8(16)5-6-9(11)15/h2-7H,1H3,(H,18,19)
InChIKeyLBDAAYKAIQRMSF-UHFFFAOYSA-N
MW342.14 g/mol
LogP3.99
Rot. Bonds3

About N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide

N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide (PubChem CID 103756076) has the molecular formula C14H10BrF2NO2 and a molecular weight of 342.14 g/mol. Its IUPAC name is N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide
PubChem CID103756076
Molecular FormulaC14H10BrF2NO2
Molecular Weight342.14 g/mol
Exact Mass340.99
IUPAC NameN-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1cc(F)ccc1Br
InChIInChI=1S/C14H10BrF2NO2/c1-20-12-4-2-3-10(17)13(12)14(19)18-11-7-8(16)5-6-9(11)15/h2-7H,1H3,(H,18,19)
InChIKeyLBDAAYKAIQRMSF-UHFFFAOYSA-N
XLogP3.99
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.14
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide
CID 81272722
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
CID 65432090
2-fluoro-N-(4-fluoro-2-iodophenyl)-6-methoxybenzamide
CID 79766807
N-(4-bromo-2-methylphenyl)-2-fluoro-6-methoxybenzamide
CID 65434983
N-(2-cyano-4-fluorophenyl)-2-fluoro-6-methoxybenzamide
CID 82683757
N-(4-bromo-2-ethylphenyl)-2-fluoro-6-methoxybenzamide
CID 81287800
2-bromo-6-fluoro-N-(5-fluoro-2-methylphenyl)benzamide
CID 115678106
N-(2-amino-4,6-dibromophenyl)-2-fluoro-6-methoxybenzamide
CID 65433208
N-(2-chloro-4-hydroxyphenyl)-2-fluoro-6-methoxybenzamide
CID 65434031
2-fluoro-N-(4-iodophenyl)-6-methoxybenzamide
CID 65432477
2-amino-N-(2,4-difluorophenyl)-6-methoxybenzamide
CID 81410622
N-(2-amino-4-fluorophenyl)-2-bromo-6-fluorobenzamide
CID 114558352

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide?
The IUPAC name of N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide (CID 103756076) is N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide.
What is the SMILES notation for N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide?
The canonical SMILES for N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide is COc1cccc(F)c1C(=O)Nc1cc(F)ccc1Br.
What is the InChIKey of N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide?
The InChIKey is LBDAAYKAIQRMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF2NO2/c1-20-12-4-2-3-10(17)13(12)14(19)18-11-7-8(16)5-6-9(11)15/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide?
N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide has a molecular weight of 342.14 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide is sourced from PubChem (CID 103756076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).