N-(5-bromo-2-hydroxyphenyl)acetamide

C8H8BrNO2 — CID 975084

IUPACN-(5-bromo-2-hydroxyphenyl)acetamide
SMILESCC(=O)Nc1cc(Br)ccc1O
InChIInChI=1S/C8H8BrNO2/c1-5(11)10-7-4-6(9)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)
InChIKeyQNPOKHIASGOGJQ-UHFFFAOYSA-N
MW230.06 g/mol
LogP2.11
Rot. Bonds1

About N-(5-bromo-2-hydroxyphenyl)acetamide

N-(5-bromo-2-hydroxyphenyl)acetamide (PubChem CID 975084) has the molecular formula C8H8BrNO2 and a molecular weight of 230.06 g/mol. Its IUPAC name is N-(5-bromo-2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-hydroxyphenyl)acetamide
PubChem CID975084
Molecular FormulaC8H8BrNO2
Molecular Weight230.06 g/mol
Exact Mass228.97
IUPAC NameN-(5-bromo-2-hydroxyphenyl)acetamide
SMILESCC(=O)Nc1cc(Br)ccc1O
InChIInChI=1S/C8H8BrNO2/c1-5(11)10-7-4-6(9)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)
InChIKeyQNPOKHIASGOGJQ-UHFFFAOYSA-N
XLogP2.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.06
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-hydroxyphenyl)acetamide?
The IUPAC name of N-(5-bromo-2-hydroxyphenyl)acetamide (CID 975084) is N-(5-bromo-2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(5-bromo-2-hydroxyphenyl)acetamide?
The canonical SMILES for N-(5-bromo-2-hydroxyphenyl)acetamide is CC(=O)Nc1cc(Br)ccc1O.
What is the InChIKey of N-(5-bromo-2-hydroxyphenyl)acetamide?
The InChIKey is QNPOKHIASGOGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrNO2/c1-5(11)10-7-4-6(9)2-3-8(7)12/h2-4,12H,1H3,(H,10,11).
What are the key properties of N-(5-bromo-2-hydroxyphenyl)acetamide?
N-(5-bromo-2-hydroxyphenyl)acetamide has a molecular weight of 230.06 g/mol, XLogP of 2.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-hydroxyphenyl)acetamide is sourced from PubChem (CID 975084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).