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

C14H10BrClFNO2 — CID 81272722

IUPACN-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C14H10BrClFNO2/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)
InChIKeyJSTPGKQQRVEPMC-UHFFFAOYSA-N
MW358.59 g/mol
LogP4.50
Rot. Bonds3

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

N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide (PubChem CID 81272722) has the molecular formula C14H10BrClFNO2 and a molecular weight of 358.59 g/mol. Its IUPAC name is N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide
PubChem CID81272722
Molecular FormulaC14H10BrClFNO2
Molecular Weight358.59 g/mol
Exact Mass356.96
IUPAC NameN-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1cc(Cl)ccc1Br
InChIInChI=1S/C14H10BrClFNO2/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)
InChIKeyJSTPGKQQRVEPMC-UHFFFAOYSA-N
XLogP4.50
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.59
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-fluorophenyl)-2-fluoro-6-methoxybenzamide
CID 103756076
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
CID 65432090
N-(4-bromo-2-methylphenyl)-2-fluoro-6-methoxybenzamide
CID 65434983
N-(2-chloro-4-hydroxyphenyl)-2-fluoro-6-methoxybenzamide
CID 65434031
4-bromo-N-(2-bromo-5-chlorophenyl)-2,6-difluorobenzamide
CID 81271266
N-(2-bromo-5-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 81272413
N-(4-bromo-2-ethylphenyl)-2-fluoro-6-methoxybenzamide
CID 81287800
N-(5-bromo-2-methoxyphenyl)-2-chloro-6-fluorobenzamide
CID 47317659
2-amino-N-(2-bromo-5-chlorophenyl)-6-ethoxybenzamide
CID 81394707
2-fluoro-N-(4-fluoro-2-iodophenyl)-6-methoxybenzamide
CID 79766807
N-(2-chloro-3-pyridinyl)-2-fluoro-6-methoxybenzamide
CID 113265347
2-bromo-N-(5-chloro-2-methoxyphenyl)-4-fluorobenzamide
CID 9191956

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide?
The IUPAC name of N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide (CID 81272722) is N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide.
What is the SMILES notation for N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide?
The canonical SMILES for N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide is COc1cccc(F)c1C(=O)Nc1cc(Cl)ccc1Br.
What is the InChIKey of N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide?
The InChIKey is JSTPGKQQRVEPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO2/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-chlorophenyl)-2-fluoro-6-methoxybenzamide?
N-(2-bromo-5-chlorophenyl)-2-fluoro-6-methoxybenzamide has a molecular weight of 358.59 g/mol, XLogP of 4.50, 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-chlorophenyl)-2-fluoro-6-methoxybenzamide is sourced from PubChem (CID 81272722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).