N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide

C16H15Cl2NO4S — CID 8763575

IUPACN-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C16H15Cl2NO4S/c1-23-14-7-6-11(17)10-13(14)19-16(20)8-9-24(21,22)15-5-3-2-4-12(15)18/h2-7,10H,8-9H2,1H3,(H,19,20)
InChIKeyVBJODBPOQZRACI-UHFFFAOYSA-N
MW388.27 g/mol
LogP3.80
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide

N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide (PubChem CID 8763575) has the molecular formula C16H15Cl2NO4S and a molecular weight of 388.27 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide
PubChem CID8763575
Molecular FormulaC16H15Cl2NO4S
Molecular Weight388.27 g/mol
Exact Mass387.01
IUPAC NameN-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C16H15Cl2NO4S/c1-23-14-7-6-11(17)10-13(14)19-16(20)8-9-24(21,22)15-5-3-2-4-12(15)18/h2-7,10H,8-9H2,1H3,(H,19,20)
InChIKeyVBJODBPOQZRACI-UHFFFAOYSA-N
XLogP3.80
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.27
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenyl)acetamide
CID 2666806
N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenoxy)acetamide
CID 870474
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methyl-2-propylsulfonylbenzamide
CID 55666825
N'-(5-chloro-2-methoxyphenyl)butanediamide
CID 94271903
2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide
CID 4816687
N-(5-chloro-2-methoxyphenyl)-3-(5-chloro-2-methylanilino)propanamide
CID 109038439
3-(tert-butylamino)-N-(5-chloro-2-methoxyphenyl)propanamide
CID 54928228
N-(5-chloro-2-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
CID 27449091
2-chloro-N-(5-chloro-2-methoxyphenyl)acetamide
CID 776663
N-(5-chloro-2-methoxyphenyl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylphenyl]sulfonylpropanamide
CID 53060127
3-[tert-butyl(methylsulfonyl)amino]-N-(5-chloro-2-methoxyphenyl)propanamide
CID 113140891
methyl 2-[[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]amino]benzoate
CID 109039100

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide (CID 8763575) is N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide is COc1ccc(Cl)cc1NC(=O)CCS(=O)(=O)c1ccccc1Cl.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide?
The InChIKey is VBJODBPOQZRACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO4S/c1-23-14-7-6-11(17)10-13(14)19-16(20)8-9-24(21,22)15-5-3-2-4-12(15)18/h2-7,10H,8-9H2,1H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide?
N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide has a molecular weight of 388.27 g/mol, XLogP of 3.80, 6 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)-3-(2-chlorophenyl)sulfonylpropanamide is sourced from PubChem (CID 8763575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).