N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide

C16H11ClN2O2 — CID 122182106

IUPACN-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C16H11ClN2O2/c17-11-5-7-12(8-6-11)18-16(21)13-9-4-10-2-1-3-14(20)15(10)19-13/h1-9,20H,(H,18,21)
InChIKeyIJNKWZIDWIXKHC-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.85
Rot. Bonds2

About N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide

N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide (PubChem CID 122182106) has the molecular formula C16H11ClN2O2 and a molecular weight of 298.73 g/mol. Its IUPAC name is N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide
PubChem CID122182106
Molecular FormulaC16H11ClN2O2
Molecular Weight298.73 g/mol
Exact Mass298.05
IUPAC NameN-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C16H11ClN2O2/c17-11-5-7-12(8-6-11)18-16(21)13-9-4-10-2-1-3-14(20)15(10)19-13/h1-9,20H,(H,18,21)
InChIKeyIJNKWZIDWIXKHC-UHFFFAOYSA-N
XLogP3.85
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-hydroxy-N-(4-methoxyphenyl)quinoline-2-carboxamide
CID 122182100
8-hydroxy-N-(1H-pyrazol-5-yl)quinoline-2-carboxamide
CID 67141006
8-hydroxy-N-(2-nitrosophenyl)quinoline-2-carboxamide
CID 142849655
N-[(2-chlorophenyl)methyl]-8-hydroxyquinoline-2-carboxamide
CID 46364203
copper;bis(8-hydroxyquinoline-2-carboxylic acid)
CID 172842653
1-(8-hydroxyquinolin-2-yl)ethanone
CID 19067452
N-benzyl-8-hydroxyquinoline-2-carboxamide
CID 46364206
sodium 8-hydroxyquinoline-2-carboxylate
CID 23712843
6-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,6-dicarboxamide
CID 109100856
N-(4-chlorophenyl)-2-hydroxy-6-methylbenzamide
CID 46215145
2-N,9-N-dipyridin-3-yl-1,10-phenanthroline-2,9-dicarboxamide
CID 155927483
6-N-(4-chlorophenyl)-2-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094492

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide (CID 122182106) is N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide is O=C(Nc1ccc(Cl)cc1)c1ccc2cccc(O)c2n1.
What is the InChIKey of N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide?
The InChIKey is IJNKWZIDWIXKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN2O2/c17-11-5-7-12(8-6-11)18-16(21)13-9-4-10-2-1-3-14(20)15(10)19-13/h1-9,20H,(H,18,21).
What are the key properties of N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide?
N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide is sourced from PubChem (CID 122182106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).