N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide

C15H15BrN2O — CID 47308279

IUPACN-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(Br)ccc2C)c(C)n1
InChIInChI=1S/C15H15BrN2O/c1-9-4-6-12(16)8-14(9)18-15(19)13-7-5-10(2)17-11(13)3/h4-8H,1-3H3,(H,18,19)
InChIKeyJGNLOUZVRSSIQC-UHFFFAOYSA-N
MW319.20 g/mol
LogP4.02
Rot. Bonds2

About N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide

N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide (PubChem CID 47308279) has the molecular formula C15H15BrN2O and a molecular weight of 319.20 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
PubChem CID47308279
Molecular FormulaC15H15BrN2O
Molecular Weight319.20 g/mol
Exact Mass318.04
IUPAC NameN-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(Br)ccc2C)c(C)n1
InChIInChI=1S/C15H15BrN2O/c1-9-4-6-12(16)8-14(9)18-15(19)13-7-5-10(2)17-11(13)3/h4-8H,1-3H3,(H,18,19)
InChIKeyJGNLOUZVRSSIQC-UHFFFAOYSA-N
XLogP4.02
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-cyano-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
CID 62059398
N-(5-bromo-2-chloro-3-pyridinyl)-2,6-dimethylpyridine-3-carboxamide
CID 102979497
N-(3-bromophenyl)-2,6-dimethylpyridine-3-carboxamide
CID 47299315
N-(5-bromo-2-methylphenyl)-2,3-dihydroxybenzamide
CID 114343683
N-(2-bromo-4-chlorophenyl)-2,6-dimethylpyridine-3-carboxamide
CID 81024100
2-amino-N-(5-bromo-2-methylphenyl)benzamide
CID 43805810
N-(5-bromo-2-methylphenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 43806378
N-(5-bromo-2-methylphenyl)-2-(methylamino)benzamide
CID 61375909
2-[(2,6-dimethylpyridine-3-carbonyl)amino]-5-hydroxybenzoic acid
CID 62829376
N-(2-amino-4-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
CID 62828848
N-(5-bromo-2-methylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 61061508
2-amino-N-(5-bromo-2-methylphenyl)-3-methylbenzamide
CID 43805804

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide (CID 47308279) is N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)Nc2cc(Br)ccc2C)c(C)n1.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide?
The InChIKey is JGNLOUZVRSSIQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O/c1-9-4-6-12(16)8-14(9)18-15(19)13-7-5-10(2)17-11(13)3/h4-8H,1-3H3,(H,18,19).
What are the key properties of N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide?
N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide has a molecular weight of 319.20 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 47308279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).