N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide

C14H14BrN3O — CID 107578475

IUPACN-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2cc(C)cc(Br)c2)nc1
InChIInChI=1S/C14H14BrN3O/c1-9-5-10(15)7-12(6-9)18-14(19)13-4-3-11(16-2)8-17-13/h3-8,16H,1-2H3,(H,18,19)
InChIKeyYWUHOEHUFLENKC-UHFFFAOYSA-N
MW320.19 g/mol
LogP3.45
Rot. Bonds3

About N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide

N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide (PubChem CID 107578475) has the molecular formula C14H14BrN3O and a molecular weight of 320.19 g/mol. Its IUPAC name is N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
PubChem CID107578475
Molecular FormulaC14H14BrN3O
Molecular Weight320.19 g/mol
Exact Mass319.03
IUPAC NameN-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2cc(C)cc(Br)c2)nc1
InChIInChI=1S/C14H14BrN3O/c1-9-5-10(15)7-12(6-9)18-14(19)13-4-3-11(16-2)8-17-13/h3-8,16H,1-2H3,(H,18,19)
InChIKeyYWUHOEHUFLENKC-UHFFFAOYSA-N
XLogP3.45
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(3-bromo-5-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 107577282
N-(3,5-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639754
N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639765
N-(3-bromo-5-methylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 107578454
N-(2,5-dimethylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639933
N-(2-fluoro-4-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639628
6-[(3-bromo-5-methylphenyl)carbamoyl]-2-methylpyridine-3-carboxylic acid
CID 107577295
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
N-(3,5-dimethylphenyl)-5-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109184098
N-(4-bromo-3-nitrophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104641755
5-(3,5-dimethylanilino)-N-phenylpyridine-2-carboxamide
CID 109196969
N-(3,5-dimethylphenyl)-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109198157

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide (CID 107578475) is N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide is CNc1ccc(C(=O)Nc2cc(C)cc(Br)c2)nc1.
What is the InChIKey of N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide?
The InChIKey is YWUHOEHUFLENKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrN3O/c1-9-5-10(15)7-12(6-9)18-14(19)13-4-3-11(16-2)8-17-13/h3-8,16H,1-2H3,(H,18,19).
What are the key properties of N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide?
N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide has a molecular weight of 320.19 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-methylphenyl)-5-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 107578475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).