N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide

C18H15ClN2O3 — CID 39767959

IUPACN-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2cc(Cl)ccc2O)c2ccccc12
InChIInChI=1S/C18H15ClN2O3/c1-11-8-18(24)21(15-5-3-2-4-13(11)15)10-17(23)20-14-9-12(19)6-7-16(14)22/h2-9,22H,10H2,1H3,(H,20,23)
InChIKeyICJGISYXQIPYKM-UHFFFAOYSA-N
MW342.78 g/mol
LogP3.31
Rot. Bonds3

About N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide

N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide (PubChem CID 39767959) has the molecular formula C18H15ClN2O3 and a molecular weight of 342.78 g/mol. Its IUPAC name is N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
PubChem CID39767959
Molecular FormulaC18H15ClN2O3
Molecular Weight342.78 g/mol
Exact Mass342.08
IUPAC NameN-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2cc(Cl)ccc2O)c2ccccc12
InChIInChI=1S/C18H15ClN2O3/c1-11-8-18(24)21(15-5-3-2-4-13(11)15)10-17(23)20-14-9-12(19)6-7-16(14)22/h2-9,22H,10H2,1H3,(H,20,23)
InChIKeyICJGISYXQIPYKM-UHFFFAOYSA-N
XLogP3.31
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.78
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(5-chloro-2-methylphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
CID 39767924
N-(2,3-dichlorophenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
CID 39767922
N-(2,5-dichlorophenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763973
2-[1-[2-(5-chloro-2-hydroxyanilino)-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]acetamide
CID 145469544
2-(2-chloro-9-oxoacridin-10-yl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 6615384
N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
CID 39767925
N-(2,5-dichlorophenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
CID 4201665
2-(3-chloro-9-oxoacridin-10-yl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 22330410
N-(5-chloro-2-methylphenyl)-2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-oxoquinolin-1-yl]acetamide
CID 17251227
methyl 2-(4-methyl-2-oxoquinolin-1-yl)acetate
CID 39767914
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide
CID 46980764
N-(5-chloro-2-methoxyphenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
CID 22330285

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide (CID 39767959) is N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide is Cc1cc(=O)n(CC(=O)Nc2cc(Cl)ccc2O)c2ccccc12.
What is the InChIKey of N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide?
The InChIKey is ICJGISYXQIPYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O3/c1-11-8-18(24)21(15-5-3-2-4-13(11)15)10-17(23)20-14-9-12(19)6-7-16(14)22/h2-9,22H,10H2,1H3,(H,20,23).
What are the key properties of N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide?
N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide has a molecular weight of 342.78 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-hydroxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 39767959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).