N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide

C14H13BrN2O — CID 113230237

IUPACN-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cccc(Br)c2C)n1
InChIInChI=1S/C14H13BrN2O/c1-9-5-3-8-13(16-9)14(18)17-12-7-4-6-11(15)10(12)2/h3-8H,1-2H3,(H,17,18)
InChIKeyGUTOSMXZJZVBOS-UHFFFAOYSA-N
MW305.18 g/mol
LogP3.71
Rot. Bonds2

About N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide

N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide (PubChem CID 113230237) has the molecular formula C14H13BrN2O and a molecular weight of 305.18 g/mol. Its IUPAC name is N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide
PubChem CID113230237
Molecular FormulaC14H13BrN2O
Molecular Weight305.18 g/mol
Exact Mass304.02
IUPAC NameN-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cccc(Br)c2C)n1
InChIInChI=1S/C14H13BrN2O/c1-9-5-3-8-13(16-9)14(18)17-12-7-4-6-11(15)10(12)2/h3-8H,1-2H3,(H,17,18)
InChIKeyGUTOSMXZJZVBOS-UHFFFAOYSA-N
XLogP3.71
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.18
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide 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

N-(3-bromo-2-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107630995
N-(3-chloro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 31759188
6-methyl-N-(2-methyl-3-sulfamoylphenyl)pyridine-2-carboxamide
CID 61129334
N-(2-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31700169
N-(5-bromo-4-fluoro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 103274644
6-bromo-N-(3-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 103874055
N-(5-bromo-2-chloro-3-pyridinyl)-6-methylpyridine-2-carboxamide
CID 102979134
5-[(3-bromo-2-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 103644305
N-(3-bromo-2-methylphenyl)-3,5-dichlorobenzamide
CID 107640531
N-(3-bromo-2-methylphenyl)-2-fluorobenzamide
CID 66606524
3-amino-N-(3-bromo-2-methylphenyl)-2-chlorobenzamide
CID 107623979
N-(3-bromo-2-methylphenyl)-5-[(Z)-N'-hydroxycarbamimidoyl]pyridine-2-carboxamide
CID 107637319

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide (CID 113230237) is N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2cccc(Br)c2C)n1.
What is the InChIKey of N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide?
The InChIKey is GUTOSMXZJZVBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O/c1-9-5-3-8-13(16-9)14(18)17-12-7-4-6-11(15)10(12)2/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide?
N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide has a molecular weight of 305.18 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-2-methylphenyl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 113230237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).