N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide

C18H15ClN2O2S — CID 7755341

IUPACN-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CSc1ccc2ccccc2n1
InChIInChI=1S/C18H15ClN2O2S/c1-23-16-8-7-13(19)10-15(16)20-17(22)11-24-18-9-6-12-4-2-3-5-14(12)21-18/h2-10H,11H2,1H3,(H,20,22)
InChIKeyAJWUXJAXWWSPII-UHFFFAOYSA-N
MW358.85 g/mol
LogP4.63
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide

N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide (PubChem CID 7755341) has the molecular formula C18H15ClN2O2S and a molecular weight of 358.85 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide
PubChem CID7755341
Molecular FormulaC18H15ClN2O2S
Molecular Weight358.85 g/mol
Exact Mass358.05
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CSc1ccc2ccccc2n1
InChIInChI=1S/C18H15ClN2O2S/c1-23-16-8-7-13(19)10-15(16)20-17(22)11-24-18-9-6-12-4-2-3-5-14(12)21-18/h2-10H,11H2,1H3,(H,20,22)
InChIKeyAJWUXJAXWWSPII-UHFFFAOYSA-N
XLogP4.63
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.85
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide 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-(5-chloro-2-hydroxyphenyl)-2-quinolin-2-ylsulfanylacetamide
CID 46302557
5-chloro-2-methoxy-N'-(2-quinolin-2-ylsulfanylacetyl)benzohydrazide
CID 7754724
N-(5-chloro-2-methoxyphenyl)-2-(3-ethylquinolin-2-yl)sulfanylacetamide
CID 3207915
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-quinolin-2-ylsulfanylacetamide
CID 17421537
N-(5-chloro-2-cyanophenyl)-2-quinolin-2-ylsulfanylacetamide
CID 7755226
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-quinolin-2-ylsulfanylacetamide
CID 35942255
[2-(5-chloro-2-methoxyanilino)-2-oxoethyl] 2-quinoxalin-2-ylsulfanylacetate
CID 46794173
N-(5-chloro-2-methoxyphenyl)-2-[4-(methylamino)quinazolin-2-yl]sulfanylacetamide
CID 30970669
N-(5-chloro-2-methoxyphenyl)-2-[(4-oxo-3H-quinazolin-2-yl)sulfanyl]acetamide
CID 135452696
N-(5-chloro-2-methoxyphenyl)-2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetamide
CID 7184001
N-(2,5-dichlorophenyl)-3-quinolin-2-ylsulfanylpropanamide
CID 39765768

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide (CID 7755341) is N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide is COc1ccc(Cl)cc1NC(=O)CSc1ccc2ccccc2n1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide?
The InChIKey is AJWUXJAXWWSPII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2S/c1-23-16-8-7-13(19)10-15(16)20-17(22)11-24-18-9-6-12-4-2-3-5-14(12)21-18/h2-10H,11H2,1H3,(H,20,22).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide?
N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide has a molecular weight of 358.85 g/mol, XLogP of 4.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide is sourced from PubChem (CID 7755341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).