2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide

C14H10BrCl2NO2 — CID 60629817

IUPAC2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C14H10BrCl2NO2/c1-20-8-5-6-10(15)9(7-8)14(19)18-13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeyMQNSIQOTYUGSAE-UHFFFAOYSA-N
MW375.05 g/mol
LogP5.02
Rot. Bonds3

About 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide

2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide (PubChem CID 60629817) has the molecular formula C14H10BrCl2NO2 and a molecular weight of 375.05 g/mol. Its IUPAC name is 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide.

Molecular Properties

Compound Name2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide
PubChem CID60629817
Molecular FormulaC14H10BrCl2NO2
Molecular Weight375.05 g/mol
Exact Mass372.93
IUPAC Name2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C14H10BrCl2NO2/c1-20-8-5-6-10(15)9(7-8)14(19)18-13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19)
InChIKeyMQNSIQOTYUGSAE-UHFFFAOYSA-N
XLogP5.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.05
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(2-bromo-3-chlorophenyl)-5-methoxybenzamide
CID 103479738
2-amino-N-(2,6-dichlorophenyl)-4-methoxybenzamide
CID 110451620
2-bromo-N-(3-hydroxyphenyl)-5-methoxybenzamide
CID 28739934
2-bromo-N-(5-bromo-2-chlorophenyl)-5-methoxybenzamide
CID 62908603
2-bromo-N-(2,5-dichlorophenyl)-5-methoxybenzamide
CID 7899907
2-bromo-N-(2,6-dichlorophenyl)-5-fluorobenzamide
CID 60667247
N-(2-chloro-6-methylphenyl)-2-hydroxy-5-methoxybenzamide
CID 66255339
2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
CID 64793819
3-bromo-N-(2-bromo-5-methoxyphenyl)-2-chlorobenzamide
CID 103989322
N-(3-amino-2,6-dimethylphenyl)-2-bromo-5-methoxybenzamide
CID 24703033
2-bromo-5-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218207
2-bromo-N-(5-bromo-2-chloro-3-pyridinyl)-5-methoxybenzamide
CID 102979484

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide?
The IUPAC name of 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide (CID 60629817) is 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide.
What is the SMILES notation for 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide?
The canonical SMILES for 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide is COc1ccc(Br)c(C(=O)Nc2c(Cl)cccc2Cl)c1.
What is the InChIKey of 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide?
The InChIKey is MQNSIQOTYUGSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO2/c1-20-8-5-6-10(15)9(7-8)14(19)18-13-11(16)3-2-4-12(13)17/h2-7H,1H3,(H,18,19).
What are the key properties of 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide?
2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide has a molecular weight of 375.05 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide is sourced from PubChem (CID 60629817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).