N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide

C14H13BrN2O2 — CID 110698722

IUPACN-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(C)c(Br)c2)cc(=O)[nH]1
InChIInChI=1S/C14H13BrN2O2/c1-8-3-4-11(7-12(8)15)17-14(19)10-5-9(2)16-13(18)6-10/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyISXRRXVYQIKOGQ-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.01
Rot. Bonds2

About N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide

N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 110698722) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID110698722
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC NameN-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(C)c(Br)c2)cc(=O)[nH]1
InChIInChI=1S/C14H13BrN2O2/c1-8-3-4-11(7-12(8)15)17-14(19)10-5-9(2)16-13(18)6-10/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyISXRRXVYQIKOGQ-UHFFFAOYSA-N
XLogP3.01
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-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

3-bromo-N-(3-bromo-4-methylphenyl)-4-methylbenzamide
CID 81471558
N-(3-bromo-4-methylphenyl)-3,5-dihydroxybenzamide
CID 107703359
2-methyl-6-oxo-N-[4-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
CID 110698736
N-(3-bromo-4-methylphenyl)thiophene-3-carboxamide
CID 55027767
3-bromo-N-(3-bromo-4-methylphenyl)-5-fluorobenzamide
CID 63529818
N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
CID 59355711
3-bromo-N-(3-chloro-4-methylphenyl)-4-methylbenzamide
CID 952306
N-(3-bromo-4-methylphenyl)quinoxaline-6-carboxamide
CID 60730289
2-amino-N-(3-bromo-4-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62871680
N-(2,4-dichlorophenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698785
N-(3-bromo-4-methylphenyl)-2-chloroacetamide
CID 2110928
1-(3-bromo-4-methylphenyl)-3-(4-methylphenyl)urea
CID 60728805

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide (CID 110698722) is N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide is Cc1cc(C(=O)Nc2ccc(C)c(Br)c2)cc(=O)[nH]1.
What is the InChIKey of N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is ISXRRXVYQIKOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c1-8-3-4-11(7-12(8)15)17-14(19)10-5-9(2)16-13(18)6-10/h3-7H,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 321.17 g/mol, XLogP of 3.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 110698722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).