N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide

C19H17ClN2O3 — CID 46302523

IUPACN-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCOc1cccc2c(C)cc(=O)n(CC(=O)Nc3ccc(Cl)cc3)c12
InChIInChI=1S/C19H17ClN2O3/c1-12-10-18(24)22(19-15(12)4-3-5-16(19)25-2)11-17(23)21-14-8-6-13(20)7-9-14/h3-10H,11H2,1-2H3,(H,21,23)
InChIKeyCSOQQBQLNXXFBX-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.61
Rot. Bonds4

About N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide

N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide (PubChem CID 46302523) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide
PubChem CID46302523
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC NameN-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCOc1cccc2c(C)cc(=O)n(CC(=O)Nc3ccc(Cl)cc3)c12
InChIInChI=1S/C19H17ClN2O3/c1-12-10-18(24)22(19-15(12)4-3-5-16(19)25-2)11-17(23)21-14-8-6-13(20)7-9-14/h3-10H,11H2,1-2H3,(H,21,23)
InChIKeyCSOQQBQLNXXFBX-UHFFFAOYSA-N
XLogP3.61
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide (CID 46302523) is N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide is COc1cccc2c(C)cc(=O)n(CC(=O)Nc3ccc(Cl)cc3)c12.
What is the InChIKey of N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide?
The InChIKey is CSOQQBQLNXXFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-12-10-18(24)22(19-15(12)4-3-5-16(19)25-2)11-17(23)21-14-8-6-13(20)7-9-14/h3-10H,11H2,1-2H3,(H,21,23).
What are the key properties of N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide?
N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide has a molecular weight of 356.81 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 46302523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).