2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide

C14H12Br2N2O2 — CID 103909645

IUPAC2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2ccc(Br)nc2C)c1
InChIInChI=1S/C14H12Br2N2O2/c1-8-12(5-6-13(16)17-8)18-14(19)10-7-9(20-2)3-4-11(10)15/h3-7H,1-2H3,(H,18,19)
InChIKeyMAOLQPDITKLKHX-UHFFFAOYSA-N
MW400.07 g/mol
LogP4.18
Rot. Bonds3

About 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide

2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide (PubChem CID 103909645) has the molecular formula C14H12Br2N2O2 and a molecular weight of 400.07 g/mol. Its IUPAC name is 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide.

Molecular Properties

Compound Name2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide
PubChem CID103909645
Molecular FormulaC14H12Br2N2O2
Molecular Weight400.07 g/mol
Exact Mass397.93
IUPAC Name2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2ccc(Br)nc2C)c1
InChIInChI=1S/C14H12Br2N2O2/c1-8-12(5-6-13(16)17-8)18-14(19)10-7-9(20-2)3-4-11(10)15/h3-7H,1-2H3,(H,18,19)
InChIKeyMAOLQPDITKLKHX-UHFFFAOYSA-N
XLogP4.18
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dibromo-N-(6-bromo-2-methyl-3-pyridinyl)benzamide
CID 104920609
2-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 103274988
2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-nitrobenzamide
CID 103910150
2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
CID 64793819
2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 2446537
2-bromo-5-methoxy-N-(8-methylquinolin-5-yl)benzamide
CID 38266685
2-fluoro-4-methoxy-N-(6-methoxy-2-methyl-3-pyridinyl)benzamide
CID 71970253
2-bromo-5-methoxy-N-(2,6,8-trimethylquinolin-4-yl)benzamide
CID 43853828
2-bromo-5-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218207
2-bromo-N-(5-bromo-2-chlorophenyl)-5-methoxybenzamide
CID 62908603
2-bromo-N-(2,5-dichlorophenyl)-5-methoxybenzamide
CID 7899907
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-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide?
The IUPAC name of 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide (CID 103909645) is 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide.
What is the SMILES notation for 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide?
The canonical SMILES for 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide is COc1ccc(Br)c(C(=O)Nc2ccc(Br)nc2C)c1.
What is the InChIKey of 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide?
The InChIKey is MAOLQPDITKLKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O2/c1-8-12(5-6-13(16)17-8)18-14(19)10-7-9(20-2)3-4-11(10)15/h3-7H,1-2H3,(H,18,19).
What are the key properties of 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide?
2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide has a molecular weight of 400.07 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide is sourced from PubChem (CID 103909645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).