4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide

C13H11BrN2O2 — CID 47435797

IUPAC4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(Br)cc2O)c1
InChIInChI=1S/C13H11BrN2O2/c1-8-4-5-15-12(6-8)16-13(18)10-3-2-9(14)7-11(10)17/h2-7,17H,1H3,(H,15,16,18)
InChIKeyMYRZHBOYYMPZJO-UHFFFAOYSA-N
MW307.15 g/mol
LogP3.11
Rot. Bonds2

About 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide

4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide (PubChem CID 47435797) has the molecular formula C13H11BrN2O2 and a molecular weight of 307.15 g/mol. Its IUPAC name is 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
PubChem CID47435797
Molecular FormulaC13H11BrN2O2
Molecular Weight307.15 g/mol
Exact Mass306.00
IUPAC Name4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
SMILESCc1ccnc(NC(=O)c2ccc(Br)cc2O)c1
InChIInChI=1S/C13H11BrN2O2/c1-8-4-5-15-12(6-8)16-13(18)10-3-2-9(14)7-11(10)17/h2-7,17H,1H3,(H,15,16,18)
InChIKeyMYRZHBOYYMPZJO-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

2,4-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 1234856
4-bromo-2-methoxy-N-(4-methyl-2-pyridinyl)benzamide
CID 78988670
4-bromo-N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
CID 114932587
N-(4-chloro-2-pyridinyl)-2-hydroxy-4-methylbenzamide
CID 115883719
3,5-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 113349571
2-bromo-N-(4-methyl-2-pyridinyl)-5-sulfamoylbenzamide
CID 134050397
3-hydroxy-N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 54861359
4-bromo-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-hydroxybenzamide
CID 115603581
2-amino-4-fluoro-N-(4-methyl-2-pyridinyl)benzamide
CID 113228212
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
4-bromo-2-hydroxy-N-(1,2,4-triazin-3-yl)benzamide
CID 114388210
5-bromo-N-(4-methyl-2-pyridinyl)thiophene-2-carboxamide chloride
CID 53352579

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide (CID 47435797) is 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide is Cc1ccnc(NC(=O)c2ccc(Br)cc2O)c1.
What is the InChIKey of 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide?
The InChIKey is MYRZHBOYYMPZJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN2O2/c1-8-4-5-15-12(6-8)16-13(18)10-3-2-9(14)7-11(10)17/h2-7,17H,1H3,(H,15,16,18).
What are the key properties of 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide?
4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide 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 4-bromo-2-hydroxy-N-(4-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 47435797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).