N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide

C16H11ClN2O2 — CID 55369875

IUPACN-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1O)c1ccc2ccccc2n1
InChIInChI=1S/C16H11ClN2O2/c17-11-6-8-15(20)14(9-11)19-16(21)13-7-5-10-3-1-2-4-12(10)18-13/h1-9,20H,(H,19,21)
InChIKeyAQTMYZLUDJGQHB-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.85
Rot. Bonds2

About N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide

N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide (PubChem CID 55369875) has the molecular formula C16H11ClN2O2 and a molecular weight of 298.73 g/mol. Its IUPAC name is N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide
PubChem CID55369875
Molecular FormulaC16H11ClN2O2
Molecular Weight298.73 g/mol
Exact Mass298.05
IUPAC NameN-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1O)c1ccc2ccccc2n1
InChIInChI=1S/C16H11ClN2O2/c17-11-6-8-15(20)14(9-11)19-16(21)13-7-5-10-3-1-2-4-12(10)18-13/h1-9,20H,(H,19,21)
InChIKeyAQTMYZLUDJGQHB-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(4-chloro-2-iodophenyl)quinoline-2-carboxamide
CID 107640561
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-(2-chlorophenyl)quinoline-2-carboxamide
CID 878226
N-(5-chloro-2-hydroxyphenyl)-2-quinolin-2-ylsulfanylacetamide
CID 46302557
N-(3-hydroxy-2-methylphenyl)quinoline-2-carboxamide
CID 64794719
N'-(5-chloro-2-fluorobenzoyl)quinoline-2-carbohydrazide
CID 35065860
N-[4,5-dimethoxy-2-(quinoline-2-carbonylamino)phenyl]quinoline-2-carboxamide
CID 91594053
N-[8-(4-chlorophenyl)naphthalen-1-yl]quinoline-2-carboxamide
CID 71659919
N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
CID 1310618
N-(2-bromo-3-chlorophenyl)quinoline-2-carboxamide
CID 103480047
N-[(2,4-dichlorophenyl)methyl]quinoline-2-carboxamide
CID 2707271
N-(5-bromo-2-chloro-3-pyridinyl)quinoline-2-carboxamide
CID 102979115

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide?
The IUPAC name of N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide (CID 55369875) is N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide is O=C(Nc1cc(Cl)ccc1O)c1ccc2ccccc2n1.
What is the InChIKey of N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide?
The InChIKey is AQTMYZLUDJGQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN2O2/c17-11-6-8-15(20)14(9-11)19-16(21)13-7-5-10-3-1-2-4-12(10)18-13/h1-9,20H,(H,19,21).
What are the key properties of N-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide?
N-(5-chloro-2-hydroxyphenyl)quinoline-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-(5-chloro-2-hydroxyphenyl)quinoline-2-carboxamide is sourced from PubChem (CID 55369875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).