2-bromo-4-hydroxybenzamide

C7H6BrNO2 — CID 103693582

IUPAC2-bromo-4-hydroxybenzamide
SMILESNC(=O)c1ccc(O)cc1Br
InChIInChI=1S/C7H6BrNO2/c8-6-3-4(10)1-2-5(6)7(9)11/h1-3,10H,(H2,9,11)
InChIKeyAJQVLNZQEFJOIF-UHFFFAOYSA-N
MW216.03 g/mol
LogP1.25
Rot. Bonds1

About 2-bromo-4-hydroxybenzamide

2-bromo-4-hydroxybenzamide (PubChem CID 103693582) has the molecular formula C7H6BrNO2 and a molecular weight of 216.03 g/mol. Its IUPAC name is 2-bromo-4-hydroxybenzamide.

Molecular Properties

Compound Name2-bromo-4-hydroxybenzamide
PubChem CID103693582
Molecular FormulaC7H6BrNO2
Molecular Weight216.03 g/mol
Exact Mass214.96
IUPAC Name2-bromo-4-hydroxybenzamide
SMILESNC(=O)c1ccc(O)cc1Br
InChIInChI=1S/C7H6BrNO2/c8-6-3-4(10)1-2-5(6)7(9)11/h1-3,10H,(H2,9,11)
InChIKeyAJQVLNZQEFJOIF-UHFFFAOYSA-N
XLogP1.25
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.03
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-4-hydroxyphenyl)-2-oxoacetic acid
CID 117363947
2-bromo-4-(trioxidanyl)benzamide
CID 143797980
2-chloro-5-hydroxybenzamide
CID 57422942
2-fluoro-5-hydroxybenzamide
CID 59402772
2-bromobenzamide;hydrochloride
CID 68911907
(2-carbamoyl-5-hydroxyphenyl) acetate
CID 11790105
4-(3-bromo-4-carbamoylanilino)benzoic acid
CID 107275335
2,4-dihydroxybenzamide;pyridine
CID 70617308
2-amino-1-(2-bromo-5-hydroxyphenyl)ethanone
CID 83711359
2-bromo-4-pyrazol-1-ylbenzamide
CID 107282932
3-(3-bromo-4-carbamoylanilino)propanoic acid
CID 107275324
[(2,4-dibromobenzoyl)amino]thiourea
CID 107941941

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-hydroxybenzamide?
The IUPAC name of 2-bromo-4-hydroxybenzamide (CID 103693582) is 2-bromo-4-hydroxybenzamide.
What is the SMILES notation for 2-bromo-4-hydroxybenzamide?
The canonical SMILES for 2-bromo-4-hydroxybenzamide is NC(=O)c1ccc(O)cc1Br.
What is the InChIKey of 2-bromo-4-hydroxybenzamide?
The InChIKey is AJQVLNZQEFJOIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrNO2/c8-6-3-4(10)1-2-5(6)7(9)11/h1-3,10H,(H2,9,11).
What are the key properties of 2-bromo-4-hydroxybenzamide?
2-bromo-4-hydroxybenzamide has a molecular weight of 216.03 g/mol, XLogP of 1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-hydroxybenzamide is sourced from PubChem (CID 103693582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).