3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide

C24H32N2O4S — CID 43873814

IUPAC3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccccc1C(C)NC(=O)CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C24H32N2O4S/c1-18(22-10-6-7-11-23(22)30-2)25-24(27)17-14-19-12-15-21(16-13-19)31(28,29)26-20-8-4-3-5-9-20/h6-7,10-13,15-16,18,20,26H,3-5,8-9,14,17H2,1-2H3,(H,25,27)
InChIKeyVEJNEUWACWGZIZ-UHFFFAOYSA-N
MW444.60 g/mol
LogP4.12
Rot. Bonds9

About 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide

3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide (PubChem CID 43873814) has the molecular formula C24H32N2O4S and a molecular weight of 444.60 g/mol. Its IUPAC name is 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
PubChem CID43873814
Molecular FormulaC24H32N2O4S
Molecular Weight444.60 g/mol
Exact Mass444.21
IUPAC Name3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccccc1C(C)NC(=O)CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C24H32N2O4S/c1-18(22-10-6-7-11-23(22)30-2)25-24(27)17-14-19-12-15-21(16-13-19)31(28,29)26-20-8-4-3-5-9-20/h6-7,10-13,15-16,18,20,26H,3-5,8-9,14,17H2,1-2H3,(H,25,27)
InChIKeyVEJNEUWACWGZIZ-UHFFFAOYSA-N
XLogP4.12
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.60
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(cyclohexylsulfamoyl)phenoxy]-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide
CID 28551884
N-[1-(2-methoxyphenyl)ethyl]-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 43873806
N-[1-(2-methoxyphenyl)ethyl]-3-[4-(2-methylpropylsulfamoyl)phenyl]propanamide
CID 43873798
3-[4-(dimethylsulfamoyl)phenyl]-N-[(1S)-1-(2-methoxyphenyl)ethyl]propanamide
CID 28557375
2-[2-chloro-4-(cyclopentylsulfamoyl)phenoxy]-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
CID 28556105
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[1-(7-methoxy-1-benzofuran-2-yl)ethyl]propanamide
CID 55588325
3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 78771407
3-[4-(cyclohexylsulfamoyl)phenyl]propanoate
CID 7330268
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[1-(4-methoxyphenyl)-2-methylpropyl]propanamide
CID 55579481
3-(3,4-dimethylphenyl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 133160279
2-cyclohexyl-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144509
N-[4-(cyclohexylsulfamoyl)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 4627504

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The IUPAC name of 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide (CID 43873814) is 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide is COc1ccccc1C(C)NC(=O)CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1.
What is the InChIKey of 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The InChIKey is VEJNEUWACWGZIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O4S/c1-18(22-10-6-7-11-23(22)30-2)25-24(27)17-14-19-12-15-21(16-13-19)31(28,29)26-20-8-4-3-5-9-20/h6-7,10-13,15-16,18,20,26H,3-5,8-9,14,17H2,1-2H3,(H,25,27).
What are the key properties of 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide?
3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide has a molecular weight of 444.60 g/mol, XLogP of 4.12, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 43873814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).