N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide

C15H13BrN2O3 — CID 103871323

IUPACN-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(Br)c(O)c2)c1
InChIInChI=1S/C15H13BrN2O3/c1-9(19)17-11-3-2-4-12(8-11)18-15(21)10-5-6-13(16)14(20)7-10/h2-8,20H,1H3,(H,17,19)(H,18,21)
InChIKeyLZIYYQARMNDFGQ-UHFFFAOYSA-N
MW349.18 g/mol
LogP3.37
Rot. Bonds3

About N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide

N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide (PubChem CID 103871323) has the molecular formula C15H13BrN2O3 and a molecular weight of 349.18 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide
PubChem CID103871323
Molecular FormulaC15H13BrN2O3
Molecular Weight349.18 g/mol
Exact Mass348.01
IUPAC NameN-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(Br)c(O)c2)c1
InChIInChI=1S/C15H13BrN2O3/c1-9(19)17-11-3-2-4-12(8-11)18-15(21)10-5-6-13(16)14(20)7-10/h2-8,20H,1H3,(H,17,19)(H,18,21)
InChIKeyLZIYYQARMNDFGQ-UHFFFAOYSA-N
XLogP3.37
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.18
LogP ≤ 53.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-3-hydroxy-N-(3-iodophenyl)benzamide
CID 113342592
4-bromo-N-[3-(chloromethyl)phenyl]-3-hydroxybenzamide
CID 114103935
4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
CID 113342873
4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide
CID 103830447
N-(3-acetamidophenyl)-2,6-dihydroxybenzamide
CID 103748896
N-(3-bromophenyl)-3-hydroxy-4-iodobenzamide
CID 113434629
N-(3-acetamidophenyl)-2-bromopyridine-4-carboxamide
CID 71854176
N-(3-acetamidophenyl)-4-tert-butylbenzamide
CID 722339
N-(3-acetamidophenyl)-3-methylbenzamide
CID 766081
N-(3-acetamidophenyl)-3-[(4-fluorobenzoyl)amino]benzamide
CID 39889179
4-bromo-N-[3-(carbamoylamino)phenyl]-3-methylbenzamide
CID 115769554
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide?
The IUPAC name of N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide (CID 103871323) is N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide.
What is the SMILES notation for N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide?
The canonical SMILES for N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide is CC(=O)Nc1cccc(NC(=O)c2ccc(Br)c(O)c2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide?
The InChIKey is LZIYYQARMNDFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O3/c1-9(19)17-11-3-2-4-12(8-11)18-15(21)10-5-6-13(16)14(20)7-10/h2-8,20H,1H3,(H,17,19)(H,18,21).
What are the key properties of N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide?
N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide has a molecular weight of 349.18 g/mol, XLogP of 3.37, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide is sourced from PubChem (CID 103871323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).