N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide

C19H17ClN2O3 — CID 5308259

IUPACN-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(Cl)cc1
InChIInChI=1S/C19H17ClN2O3/c1-21(14-9-7-13(20)8-10-14)19(24)12-25-17-11-18(23)22(2)16-6-4-3-5-15(16)17/h3-11H,12H2,1-2H3
InChIKeyZMODDSLUXAGNBJ-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.23
Rot. Bonds4

About N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide

N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide (PubChem CID 5308259) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
PubChem CID5308259
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC NameN-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(Cl)cc1
InChIInChI=1S/C19H17ClN2O3/c1-21(14-9-7-13(20)8-10-14)19(24)12-25-17-11-18(23)22(2)16-6-4-3-5-15(16)17/h3-11H,12H2,1-2H3
InChIKeyZMODDSLUXAGNBJ-UHFFFAOYSA-N
XLogP3.23
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Ketazolam
CID 33746
6-Chloro-4-(cyclohexyloxy)-3-propylquinolin-2(1H)-one
CID 448724
6-Chloro-4-(cyclohexyloxy)-3-isopropylquinolin-2(1H)-one
CID 448729
6-chloro-4-(cyclohexylmethoxy)-3-propyl-1H-quinolin-2-one
CID 503377
6-chloro-4-(cyclobutylmethoxy)-3-ethoxy-1H-quinolin-2-one
CID 503391
N-(2-chloro-4-fluorobenzyl)-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide
CID 16193338
2-(Benzyloxy)-1-(4-(2,4-dichlorophenyl)piperazin-1-yl)ethanone
CID 24762950
2-(Benzyloxy)-1-(4-(2-chlorophenyl)piperazin-1-yl)ethanone
CID 24762952
2-(Benzyloxy)-1-(4-(4-chlorophenyl)piperazin-1-yl)ethanone
CID 52942601
N-(3-chlorophenyl)-N-ethyl-2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetamide
CID 3236055
Ethyl 4-{[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]acetyl}piperazine-1-carboxylate
CID 3238108
4-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethoxy]-1-methylquinolin-2(1H)-one
CID 3238431

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The IUPAC name of N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide (CID 5308259) is N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide.
What is the SMILES notation for N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The canonical SMILES for N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide is CN(C(=O)COc1cc(=O)n(C)c2ccccc12)c1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
The InChIKey is ZMODDSLUXAGNBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-21(14-9-7-13(20)8-10-14)19(24)12-25-17-11-18(23)22(2)16-6-4-3-5-15(16)17/h3-11H,12H2,1-2H3.
What are the key properties of N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide?
N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide has a molecular weight of 356.81 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-N-methyl-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide is sourced from PubChem (CID 5308259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).