4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide

C12H10BrN3O2 — CID 107073952

IUPAC4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide
SMILESNc1ccc(C(=O)Nc2ccc(Br)cn2)cc1O
InChIInChI=1S/C12H10BrN3O2/c13-8-2-4-11(15-6-8)16-12(18)7-1-3-9(14)10(17)5-7/h1-6,17H,14H2,(H,15,16,18)
InChIKeyJYPVWRBQMOUEGB-UHFFFAOYSA-N
MW308.14 g/mol
LogP2.38
Rot. Bonds2

About 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide

4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide (PubChem CID 107073952) has the molecular formula C12H10BrN3O2 and a molecular weight of 308.14 g/mol. Its IUPAC name is 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide
PubChem CID107073952
Molecular FormulaC12H10BrN3O2
Molecular Weight308.14 g/mol
Exact Mass307.00
IUPAC Name4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide
SMILESNc1ccc(C(=O)Nc2ccc(Br)cn2)cc1O
InChIInChI=1S/C12H10BrN3O2/c13-8-2-4-11(15-6-8)16-12(18)7-1-3-9(14)10(17)5-7/h1-6,17H,14H2,(H,15,16,18)
InChIKeyJYPVWRBQMOUEGB-UHFFFAOYSA-N
XLogP2.38
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.14
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze 4-amino-N-(5-bromo-2-pyridinyl)-3-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-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
CID 103956611
N-(5-bromo-2-pyridinyl)-2,6-dichloropyridine-4-carboxamide
CID 43132088
2-amino-N-(5-bromo-2-pyridinyl)benzamide
CID 13348356
N-(5-bromo-2-pyridinyl)-4-iodobenzamide
CID 4066488
N-(5-bromo-2-pyridinyl)-4-hydrazinyl-3-methylbenzamide
CID 63212020
2-amino-N-(5-bromo-2-pyridinyl)-5-nitrobenzamide
CID 62155081
N-(5-bromo-2-pyridinyl)-3,5-dimethylbenzamide
CID 953685
3-bromo-N-(5-bromo-2-pyridinyl)-4-methoxybenzamide
CID 23935414
4-amino-3-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
CID 107073933
4-[(5-bromo-2-pyridinyl)carbamoyl]pyridine-2-carboxylic acid
CID 113384992
5-amino-N-(5-bromo-2-pyridinyl)-2,4-difluorobenzamide
CID 61092770
2-amino-N-(5-bromo-2-pyridinyl)-4-chlorobenzamide
CID 28893277

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide?
The IUPAC name of 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide (CID 107073952) is 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide?
The canonical SMILES for 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide is Nc1ccc(C(=O)Nc2ccc(Br)cn2)cc1O.
What is the InChIKey of 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide?
The InChIKey is JYPVWRBQMOUEGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3O2/c13-8-2-4-11(15-6-8)16-12(18)7-1-3-9(14)10(17)5-7/h1-6,17H,14H2,(H,15,16,18).
What are the key properties of 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide?
4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide has a molecular weight of 308.14 g/mol, XLogP of 2.38, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide is sourced from PubChem (CID 107073952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).