N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide

C12H9ClN2O2 — CID 103875090

IUPACN-(6-chloro-3-pyridinyl)-4-hydroxybenzamide
SMILESO=C(Nc1ccc(Cl)nc1)c1ccc(O)cc1
InChIInChI=1S/C12H9ClN2O2/c13-11-6-3-9(7-14-11)15-12(17)8-1-4-10(16)5-2-8/h1-7,16H,(H,15,17)
InChIKeyUDROINVSBBGIGA-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.69
Rot. Bonds2

About N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide

N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide (PubChem CID 103875090) has the molecular formula C12H9ClN2O2 and a molecular weight of 248.67 g/mol. Its IUPAC name is N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(6-chloro-3-pyridinyl)-4-hydroxybenzamide
PubChem CID103875090
Molecular FormulaC12H9ClN2O2
Molecular Weight248.67 g/mol
Exact Mass248.04
IUPAC NameN-(6-chloro-3-pyridinyl)-4-hydroxybenzamide
SMILESO=C(Nc1ccc(Cl)nc1)c1ccc(O)cc1
InChIInChI=1S/C12H9ClN2O2/c13-11-6-3-9(7-14-11)15-12(17)8-1-4-10(16)5-2-8/h1-7,16H,(H,15,17)
InChIKeyUDROINVSBBGIGA-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(6-chloro-3-pyridinyl)-4-(trifluoromethyl)benzamide
CID 3719290
N-(6-amino-3-pyridinyl)-4-hydroxybenzamide
CID 62900503
N-(6-bromo-3-pyridinyl)-6-chloropyridine-3-carboxamide
CID 103789282
6-bromo-N-(6-chloro-3-pyridinyl)pyridine-3-carboxamide
CID 79420958
N-(6-chloro-3-pyridinyl)-4-ethoxybenzamide
CID 54787908
6-chloro-N-(2-chloropyrimidin-5-yl)pyridine-3-carboxamide
CID 10125350
N-(6-chloro-3-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
CID 78929856
3-bromo-4-chloro-N-(6-chloro-3-pyridinyl)benzamide
CID 113329917
4-butoxy-N-(6-chloro-3-pyridinyl)benzamide
CID 54787952
2-amino-N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide
CID 150110924
N-(6-chloro-3-pyridinyl)-4-(2-methylpropoxy)benzamide
CID 54787953
N-(6-chloro-3-pyridinyl)-4-(3-hydroxybutanoylamino)benzamide
CID 110178942

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide?
The IUPAC name of N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide (CID 103875090) is N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide.
What is the SMILES notation for N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide?
The canonical SMILES for N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide is O=C(Nc1ccc(Cl)nc1)c1ccc(O)cc1.
What is the InChIKey of N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide?
The InChIKey is UDROINVSBBGIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O2/c13-11-6-3-9(7-14-11)15-12(17)8-1-4-10(16)5-2-8/h1-7,16H,(H,15,17).
What are the key properties of N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide?
N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide 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 N-(6-chloro-3-pyridinyl)-4-hydroxybenzamide is sourced from PubChem (CID 103875090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).