5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide

C12H9ClN2O2 — CID 3011446

IUPAC5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1cc(Cl)ccc1O
InChIInChI=1S/C12H9ClN2O2/c13-8-1-2-11(16)10(7-8)12(17)15-9-3-5-14-6-4-9/h1-7,16H,(H,14,15,17)
InChIKeyGOFGQNJZBLJUBR-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.69
Rot. Bonds2

About 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide

5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide (PubChem CID 3011446) has the molecular formula C12H9ClN2O2 and a molecular weight of 248.67 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide
PubChem CID3011446
Molecular FormulaC12H9ClN2O2
Molecular Weight248.67 g/mol
Exact Mass248.04
IUPAC Name5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1cc(Cl)ccc1O
InChIInChI=1S/C12H9ClN2O2/c13-8-1-2-11(16)10(7-8)12(17)15-9-3-5-14-6-4-9/h1-7,16H,(H,14,15,17)
InChIKeyGOFGQNJZBLJUBR-UHFFFAOYSA-N
XLogP2.69
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

US20200361871A1, Example 36
CID 139347764
2-methoxy-N-pyridin-4-ylbenzamide
CID 814758
N'-[(E)-(5-chloro-2-hydroxyphenyl)methylidene]pyridine-4-carbohydrazide
CID 135458873
N'-[(E)-(5-chloro-2-hydroxyphenyl)methylidene]pyridine-3-carbohydrazide
CID 135533081
2-hydroxy-N-((pyridin-2-yl)methyl)benzamide
CID 778091
5-chloro-N-(2-chloropyridin-3-yl)-2-methoxybenzamide
CID 3154652
2-(benzyloxy)-5-chloro-N-pyridin-3-ylbenzamide
CID 6463365
5-chloro-N-(3-chloropyridin-4-yl)-2-hydroxybenzamide
CID 46836254
5-chloro-2-methoxy-N-pyridin-4-ylbenzamide
CID 868972
2-hydroxy-N-(pyridin-3-yl)benzamide
CID 578240
N-(5-chloro-2-hydroxyphenyl)-4-[(pyridin-4-ylamino)methyl]benzamide
CID 25218549
(E)-1-(5-chloro-2-hydroxyphenyl)-3-pyridin-4-ylprop-2-en-1-one
CID 5357374

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide (CID 3011446) is 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide is O=C(Nc1ccncc1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide?
The InChIKey is GOFGQNJZBLJUBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O2/c13-8-1-2-11(16)10(7-8)12(17)15-9-3-5-14-6-4-9/h1-7,16H,(H,14,15,17).
What are the key properties of 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide?
5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide has a molecular weight of 248.67 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 3011446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).