N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

C19H16ClN3O3 — CID 100735847

IUPACN-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cn2ccc(=O)c3cc(Cl)ccc32)c1
InChIInChI=1S/C19H16ClN3O3/c1-12(24)21-14-3-2-4-15(10-14)22-19(26)11-23-8-7-18(25)16-9-13(20)5-6-17(16)23/h2-10H,11H2,1H3,(H,21,24)(H,22,26)
InChIKeyAXGTXFMDDFKUTF-UHFFFAOYSA-N
MW369.81 g/mol
LogP3.25
Rot. Bonds4

About N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (PubChem CID 100735847) has the molecular formula C19H16ClN3O3 and a molecular weight of 369.81 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
PubChem CID100735847
Molecular FormulaC19H16ClN3O3
Molecular Weight369.81 g/mol
Exact Mass369.09
IUPAC NameN-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)Cn2ccc(=O)c3cc(Cl)ccc32)c1
InChIInChI=1S/C19H16ClN3O3/c1-12(24)21-14-3-2-4-15(10-14)22-19(26)11-23-8-7-18(25)16-9-13(20)5-6-17(16)23/h2-10H,11H2,1H3,(H,21,24)(H,22,26)
InChIKeyAXGTXFMDDFKUTF-UHFFFAOYSA-N
XLogP3.25
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43833238
N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43832718
N-(4-chlorophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741578
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,4-dichlorophenyl)acetamide
CID 100735074
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide
CID 100734953
N-(3-bromophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741597
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100734930
N-butyl-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 100734647
2-(7-chloro-4-oxoquinolin-1-yl)-N-(4-chlorophenyl)acetamide
CID 100738455
2-(6-chloro-4-oxoquinolin-1-yl)-N-[(2-chlorophenyl)methyl]acetamide
CID 100734816
2-(4-acetamidoindol-1-yl)-N-(3-acetylphenyl)acetamide
CID 71828766
2-(6-chloroindol-1-yl)-N-(3-methylphenyl)acetamide
CID 115590570

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (CID 100735847) is N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is CC(=O)Nc1cccc(NC(=O)Cn2ccc(=O)c3cc(Cl)ccc32)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The InChIKey is AXGTXFMDDFKUTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O3/c1-12(24)21-14-3-2-4-15(10-14)22-19(26)11-23-8-7-18(25)16-9-13(20)5-6-17(16)23/h2-10H,11H2,1H3,(H,21,24)(H,22,26).
What are the key properties of N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide has a molecular weight of 369.81 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 100735847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).