4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide

C14H13BrN2O2 — CID 114932587

IUPAC4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
SMILESCc1cc(C)nc(NC(=O)c2ccc(Br)cc2O)c1
InChIInChI=1S/C14H13BrN2O2/c1-8-5-9(2)16-13(6-8)17-14(19)11-4-3-10(15)7-12(11)18/h3-7,18H,1-2H3,(H,16,17,19)
InChIKeyQIRYQHPKXLYPEY-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.42
Rot. Bonds2

About 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide

4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide (PubChem CID 114932587) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
PubChem CID114932587
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC Name4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
SMILESCc1cc(C)nc(NC(=O)c2ccc(Br)cc2O)c1
InChIInChI=1S/C14H13BrN2O2/c1-8-5-9(2)16-13(6-8)17-14(19)11-4-3-10(15)7-12(11)18/h3-7,18H,1-2H3,(H,16,17,19)
InChIKeyQIRYQHPKXLYPEY-UHFFFAOYSA-N
XLogP3.42
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide 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-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
CID 13440640
4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
CID 47435797
3-amino-2-bromo-N-(4,6-dimethyl-2-pyridinyl)benzamide
CID 114931712
4-bromo-N-(6-chloro-2-pyridinyl)-2-hydroxybenzamide
CID 104820162
6-bromo-N-(4,6-dimethyl-2-pyridinyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
CID 54698101
4-bromo-N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-hydroxybenzamide
CID 65488541
4-bromo-2-hydroxy-N-(3-hydroxy-4-methylphenyl)benzamide
CID 64793271
4-bromo-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-hydroxybenzamide
CID 115603581
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
N-(4,6-dimethyl-2-pyridinyl)-4-iodobenzamide
CID 115750615
2,4-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 1234856
2,6-dichloro-N-(4,6-dimethyl-2-pyridinyl)benzamide
CID 5099860

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide?
The IUPAC name of 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide (CID 114932587) is 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide.
What is the SMILES notation for 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide?
The canonical SMILES for 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide is Cc1cc(C)nc(NC(=O)c2ccc(Br)cc2O)c1.
What is the InChIKey of 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide?
The InChIKey is QIRYQHPKXLYPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c1-8-5-9(2)16-13(6-8)17-14(19)11-4-3-10(15)7-12(11)18/h3-7,18H,1-2H3,(H,16,17,19).
What are the key properties of 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide?
4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide has a molecular weight of 321.17 g/mol, XLogP of 3.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide is sourced from PubChem (CID 114932587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).