N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide

C22H30N2O5S — CID 19180421

IUPACN-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(S(=O)(=O)N(CC)CC)ccc2OC)cc1
InChIInChI=1S/C22H30N2O5S/c1-5-8-17-9-11-18(12-10-17)29-16-22(25)23-20-15-19(13-14-21(20)28-4)30(26,27)24(6-2)7-3/h9-15H,5-8,16H2,1-4H3,(H,23,25)
InChIKeyOJRGOWFUGVADGE-UHFFFAOYSA-N
MW434.56 g/mol
LogP3.70
Rot. Bonds11

About N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide

N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide (PubChem CID 19180421) has the molecular formula C22H30N2O5S and a molecular weight of 434.56 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide
PubChem CID19180421
Molecular FormulaC22H30N2O5S
Molecular Weight434.56 g/mol
Exact Mass434.19
IUPAC NameN-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(S(=O)(=O)N(CC)CC)ccc2OC)cc1
InChIInChI=1S/C22H30N2O5S/c1-5-8-17-9-11-18(12-10-17)29-16-22(25)23-20-15-19(13-14-21(20)28-4)30(26,27)24(6-2)7-3/h9-15H,5-8,16H2,1-4H3,(H,23,25)
InChIKeyOJRGOWFUGVADGE-UHFFFAOYSA-N
XLogP3.70
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.56
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide (CID 19180421) is N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide is CCCc1ccc(OCC(=O)Nc2cc(S(=O)(=O)N(CC)CC)ccc2OC)cc1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide?
The InChIKey is OJRGOWFUGVADGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O5S/c1-5-8-17-9-11-18(12-10-17)29-16-22(25)23-20-15-19(13-14-21(20)28-4)30(26,27)24(6-2)7-3/h9-15H,5-8,16H2,1-4H3,(H,23,25).
What are the key properties of N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide?
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide has a molecular weight of 434.56 g/mol, XLogP of 3.70, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-propylphenoxy)acetamide is sourced from PubChem (CID 19180421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).