4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide

C14H13BrN2O2 — CID 78988670

IUPAC4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
SMILESCOc1cc(Br)ccc1C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C14H13BrN2O2/c1-9-5-6-16-13(7-9)17-14(18)11-4-3-10(15)8-12(11)19-2/h3-8H,1-2H3,(H,16,17,18)
InChIKeyQHINUIPMSKUZFY-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.41
Rot. Bonds3

About 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide

4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide (PubChem CID 78988670) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
PubChem CID78988670
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC Name4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
SMILESCOc1cc(Br)ccc1C(=O)Nc1cc(C)ccn1
InChIInChI=1S/C14H13BrN2O2/c1-9-5-6-16-13(7-9)17-14(18)11-4-3-10(15)8-12(11)19-2/h3-8H,1-2H3,(H,16,17,18)
InChIKeyQHINUIPMSKUZFY-UHFFFAOYSA-N
XLogP3.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide 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

2,4-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 1234856
4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
CID 47435797
4-bromo-2-methoxy-N-(2-methoxy-4-methylphenyl)benzamide
CID 78987785
5-chloro-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
CID 762528
4-bromo-N-(2-bromo-3-pyridinyl)-2-methoxybenzamide
CID 103819401
4-bromo-2-methoxy-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 115610368
4-bromo-N-(5-bromo-2-methoxyphenyl)-2-methoxybenzamide
CID 78987917
3,5-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 113349571
3-bromo-4-ethoxy-5-methoxy-N-(4-methyl-2-pyridinyl)benzamide
CID 35027407
N-(4-bromo-2-pyridinyl)-3,4-dimethoxybenzamide
CID 102674424
N-(4-bromo-2-pyridinyl)-3,4,5-trimethoxybenzamide
CID 127109293
4-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-2-methoxybenzamide
CID 103745322

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide (CID 78988670) is 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide is COc1cc(Br)ccc1C(=O)Nc1cc(C)ccn1.
What is the InChIKey of 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide?
The InChIKey is QHINUIPMSKUZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c1-9-5-6-16-13(7-9)17-14(18)11-4-3-10(15)8-12(11)19-2/h3-8H,1-2H3,(H,16,17,18).
What are the key properties of 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide?
4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide has a molecular weight of 321.17 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 78988670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).