N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide

C12H9BrN2O2 — CID 63851687

IUPACN-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cncc(O)c1
InChIInChI=1S/C12H9BrN2O2/c13-9-1-3-10(4-2-9)15-12(17)8-5-11(16)7-14-6-8/h1-7,16H,(H,15,17)
InChIKeyDLPXQQAVTGXXMU-UHFFFAOYSA-N
MW293.12 g/mol
LogP2.80
Rot. Bonds2

About N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide

N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63851687) has the molecular formula C12H9BrN2O2 and a molecular weight of 293.12 g/mol. Its IUPAC name is N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide
PubChem CID63851687
Molecular FormulaC12H9BrN2O2
Molecular Weight293.12 g/mol
Exact Mass291.98
IUPAC NameN-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cncc(O)c1
InChIInChI=1S/C12H9BrN2O2/c13-9-1-3-10(4-2-9)15-12(17)8-5-11(16)7-14-6-8/h1-7,16H,(H,15,17)
InChIKeyDLPXQQAVTGXXMU-UHFFFAOYSA-N
XLogP2.80
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.12
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide (CID 63851687) is N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide is O=C(Nc1ccc(Br)cc1)c1cncc(O)c1.
What is the InChIKey of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is DLPXQQAVTGXXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrN2O2/c13-9-1-3-10(4-2-9)15-12(17)8-5-11(16)7-14-6-8/h1-7,16H,(H,15,17).
What are the key properties of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 293.12 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63851687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).