N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide

C18H15ClN2O2 — CID 11727151

IUPACN-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide
SMILESCC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2n(C)c1=O
InChIInChI=1S/C18H15ClN2O2/c1-11(22)20-17-16(12-6-4-3-5-7-12)14-10-13(19)8-9-15(14)21(2)18(17)23/h3-10H,1-2H3,(H,20,22)
InChIKeyYKJZOCCSOQGQLF-UHFFFAOYSA-N
MW326.78 g/mol
LogP3.82
Rot. Bonds2

About N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide

N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide (PubChem CID 11727151) has the molecular formula C18H15ClN2O2 and a molecular weight of 326.78 g/mol. Its IUPAC name is N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide
PubChem CID11727151
Molecular FormulaC18H15ClN2O2
Molecular Weight326.78 g/mol
Exact Mass326.08
IUPAC NameN-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide
SMILESCC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2n(C)c1=O
InChIInChI=1S/C18H15ClN2O2/c1-11(22)20-17-16(12-6-4-3-5-7-12)14-10-13(19)8-9-15(14)21(2)18(17)23/h3-10H,1-2H3,(H,20,22)
InChIKeyYKJZOCCSOQGQLF-UHFFFAOYSA-N
XLogP3.82
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.78
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chloro-1-methyl-3-phenylindol-2-yl) hydrogen carbonate
CID 67802401
N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide
CID 44561346
6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one
CID 134306095
ethyl N-(5-chloro-1-methyl-3-phenylindol-2-yl)carbamate
CID 21387993
6-chloro-4-(4-chlorophenyl)-3-iodo-1-methylquinolin-2-one
CID 132992766
6-chloro-4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54717880
6-chloro-3-[3-(furan-2-yl)prop-2-enoyl]-1-methyl-4-phenylquinolin-2-one
CID 3158329
6-chloro-3-(2-hydrazinyl-1,3-thiazol-4-yl)-1-methyl-4-phenylquinolin-2-one
CID 53348929
N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)acetamide
CID 10686612
methyl 2-(3-acetyl-6-chloro-2-oxo-4-phenylquinolin-1-yl)acetate
CID 139937850
3-[(3R)-2-acetyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl]-6-chloro-1-methyl-4-phenylquinolin-2-one
CID 40804375
N-(6-chloro-4-phenylquinolin-3-yl)acetamide
CID 10424681

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide?
The IUPAC name of N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide (CID 11727151) is N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide.
What is the SMILES notation for N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide?
The canonical SMILES for N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide is CC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2n(C)c1=O.
What is the InChIKey of N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide?
The InChIKey is YKJZOCCSOQGQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2/c1-11(22)20-17-16(12-6-4-3-5-7-12)14-10-13(19)8-9-15(14)21(2)18(17)23/h3-10H,1-2H3,(H,20,22).
What are the key properties of N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide?
N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide has a molecular weight of 326.78 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide is sourced from PubChem (CID 11727151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).