4-chloro-N-hydroxybenzamide

C7H6ClNO2 — CID 587178

IUPAC4-chloro-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(Cl)cc1
InChIInChI=1S/C7H6ClNO2/c8-6-3-1-5(2-4-6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyDODOQPRLYSBBHR-UHFFFAOYSA-N
MW171.58 g/mol
LogP1.46
Rot. Bonds1

About 4-chloro-N-hydroxybenzamide

4-chloro-N-hydroxybenzamide (PubChem CID 587178) has the molecular formula C7H6ClNO2 and a molecular weight of 171.58 g/mol. Its IUPAC name is 4-chloro-N-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-hydroxybenzamide
PubChem CID587178
Molecular FormulaC7H6ClNO2
Molecular Weight171.58 g/mol
Exact Mass171.01
IUPAC Name4-chloro-N-hydroxybenzamide
SMILESO=C(NO)c1ccc(Cl)cc1
InChIInChI=1S/C7H6ClNO2/c8-6-3-1-5(2-4-6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyDODOQPRLYSBBHR-UHFFFAOYSA-N
XLogP1.46
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.58
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

sodium N-(4-chlorobenzoyl)sulfamate
CID 23702299
N-acetyl-4-chlorobenzamide
CID 11735747
4-[5-(4-chlorophenyl)-4-hydroxy-1H-pyrazol-3-yl]-N-hydroxybenzamide
CID 170556894
N'-acetyl-4-chlorobenzohydrazide
CID 799230
4-chloro-N-propan-2-ylbenzamide
CID 24045
N-(4-chlorobenzoyl)-4-methylbenzamide
CID 122212331
4-amino-N'-(4-chlorobenzoyl)benzohydrazide
CID 785216
N-(4-chlorophenyl)-4-[(E)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]ethenyl]benzamide
CID 134119182
4-chloro-N-[(4-chlorophenyl)sulfonimidoyl]benzamide
CID 155806628
N-hydroxybenzamide;nickel
CID 88846751
2-[(4-chlorobenzoyl)amino]acetyl chloride
CID 14545092
N'-(4-chlorobenzoyl)pyridine-4-carbohydrazide
CID 960057

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-hydroxybenzamide?
The IUPAC name of 4-chloro-N-hydroxybenzamide (CID 587178) is 4-chloro-N-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-hydroxybenzamide is O=C(NO)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-hydroxybenzamide?
The InChIKey is DODOQPRLYSBBHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClNO2/c8-6-3-1-5(2-4-6)7(10)9-11/h1-4,11H,(H,9,10).
What are the key properties of 4-chloro-N-hydroxybenzamide?
4-chloro-N-hydroxybenzamide has a molecular weight of 171.58 g/mol, XLogP of 1.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-hydroxybenzamide is sourced from PubChem (CID 587178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).