N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide

C22H23ClN2O4 — CID 5309310

IUPACN-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCCN(C(=O)COc1cc(=O)n(CC)c2ccccc12)c1cc(Cl)ccc1OC
InChIInChI=1S/C22H23ClN2O4/c1-4-24-17-9-7-6-8-16(17)20(13-21(24)26)29-14-22(27)25(5-2)18-12-15(23)10-11-19(18)28-3/h6-13H,4-5,14H2,1-3H3
InChIKeyNODLJAPEOKUJHZ-UHFFFAOYSA-N
MW414.89 g/mol
LogP4.12
Rot. Bonds7

About N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide

N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide (PubChem CID 5309310) has the molecular formula C22H23ClN2O4 and a molecular weight of 414.89 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide
PubChem CID5309310
Molecular FormulaC22H23ClN2O4
Molecular Weight414.89 g/mol
Exact Mass414.13
IUPAC NameN-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide
SMILESCCN(C(=O)COc1cc(=O)n(CC)c2ccccc12)c1cc(Cl)ccc1OC
InChIInChI=1S/C22H23ClN2O4/c1-4-24-17-9-7-6-8-16(17)20(13-21(24)26)29-14-22(27)25(5-2)18-12-15(23)10-11-19(18)28-3/h6-13H,4-5,14H2,1-3H3
InChIKeyNODLJAPEOKUJHZ-UHFFFAOYSA-N
XLogP4.12
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.89
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-chloro-2-phenoxyphenyl)-N-(2-isopropoxybenzyl)acetamide
CID 9844410
N-(2-ethoxybenzyl)-N-(4-chloro-2-phenoxyphenyl)acetamide
CID 11703928
N-(2-methoxybenzyl)-N-(4-chloro-2-phenoxyphenyl)acetamide
CID 11717878
4-(4-Chloro-benzyl)-4H-benzo[1,4]oxazin-3-one
CID 1088409
2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-(2-methylphenyl)acetamide
CID 954220
4-(2-Chloro-benzyl)-4H-benzo[1,4]oxazin-3-one
CID 655620
(R)-3-(2-(2-(4-(4-fluorobenzyl)-2-methylpiperazin-1-yl)-2-oxoethoxy)-5-chlorophenylamino)-4-aminocyclobut-3-ene-1,2-dione
CID 17753030
4-[(2-Chlorophenyl)methyl]-2-methyl-1,4-benzoxazin-3-one
CID 653539
2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-N-(2,3-dimethylphenyl)acetamide
CID 1091395
2-(4-Chlorophenoxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
CID 1153594
Benzyl {3-[(5-chloro-2-methoxyphenyl)amino]-3-oxopropyl}carbamate
CID 2173195
2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-N-(2-phenylphenyl)acetamide
CID 2562953

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide (CID 5309310) is N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide is CCN(C(=O)COc1cc(=O)n(CC)c2ccccc12)c1cc(Cl)ccc1OC.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide?
The InChIKey is NODLJAPEOKUJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClN2O4/c1-4-24-17-9-7-6-8-16(17)20(13-21(24)26)29-14-22(27)25(5-2)18-12-15(23)10-11-19(18)28-3/h6-13H,4-5,14H2,1-3H3.
What are the key properties of N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide?
N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide has a molecular weight of 414.89 g/mol, XLogP of 4.12, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-ethyl-2-oxoquinolin-4-yl)oxyacetamide is sourced from PubChem (CID 5309310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).