N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide

C13H11BrN2O2 — CID 79049112

IUPACN-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
SMILESCc1nc(NC(=O)c2cccc(O)c2)ccc1Br
InChIInChI=1S/C13H11BrN2O2/c1-8-11(14)5-6-12(15-8)16-13(18)9-3-2-4-10(17)7-9/h2-7,17H,1H3,(H,15,16,18)
InChIKeyLYGLHRNKJJLONR-UHFFFAOYSA-N
MW307.15 g/mol
LogP3.11
Rot. Bonds2

About N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide

N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide (PubChem CID 79049112) has the molecular formula C13H11BrN2O2 and a molecular weight of 307.15 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
PubChem CID79049112
Molecular FormulaC13H11BrN2O2
Molecular Weight307.15 g/mol
Exact Mass306.00
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
SMILESCc1nc(NC(=O)c2cccc(O)c2)ccc1Br
InChIInChI=1S/C13H11BrN2O2/c1-8-11(14)5-6-12(15-8)16-13(18)9-3-2-4-10(17)7-9/h2-7,17H,1H3,(H,15,16,18)
InChIKeyLYGLHRNKJJLONR-UHFFFAOYSA-N
XLogP3.11
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.15
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-6-methyl-2-pyridinyl)-3-methylsulfonylbenzamide
CID 79041374
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 79048356
N-(5-bromo-6-methyl-2-pyridinyl)-3,4-dichlorobenzamide
CID 4509260
4-bromo-N-(5-bromo-6-methyl-2-pyridinyl)benzamide
CID 4509258
N-(5-bromo-6-methyl-2-pyridinyl)-2,3-dihydroxybenzamide
CID 114343707
3-bromo-N-(5-bromo-6-methyl-2-pyridinyl)-5-methylbenzamide
CID 113460607
N-(5-bromo-6-methyl-2-pyridinyl)thiophene-3-carboxamide
CID 79048508
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
CID 79049145
N-(5-bromo-6-methyl-2-pyridinyl)-2-chloropyridine-4-carboxamide
CID 71987347
N-(5-bromo-6-methyl-2-pyridinyl)-5-iodothiophene-3-carboxamide
CID 79116772
2-(aminomethyl)-N-(5-bromo-6-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 114326756
6-[(3-hydroxybenzoyl)amino]pyridine-2-carboxylic acid
CID 55249899

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide (CID 79049112) is N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide is Cc1nc(NC(=O)c2cccc(O)c2)ccc1Br.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide?
The InChIKey is LYGLHRNKJJLONR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN2O2/c1-8-11(14)5-6-12(15-8)16-13(18)9-3-2-4-10(17)7-9/h2-7,17H,1H3,(H,15,16,18).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide?
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide has a molecular weight of 307.15 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide is sourced from PubChem (CID 79049112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).