5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide

C25H35N3O5S — CID 55371511

IUPAC5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide
SMILESCCC(NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1)c1ccc(OC)cc1
InChIInChI=1S/C25H35N3O5S/c1-5-23(19-8-10-20(32-4)11-9-19)26-25(29)22-18-21(34(30,31)28(6-2)7-3)12-13-24(22)27-14-16-33-17-15-27/h8-13,18,23H,5-7,14-17H2,1-4H3,(H,26,29)
InChIKeyGJTSPZFFSFXRLO-UHFFFAOYSA-N
MW489.64 g/mol
LogP3.44
Rot. Bonds10

About 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide

5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide (PubChem CID 55371511) has the molecular formula C25H35N3O5S and a molecular weight of 489.64 g/mol. Its IUPAC name is 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide
PubChem CID55371511
Molecular FormulaC25H35N3O5S
Molecular Weight489.64 g/mol
Exact Mass489.23
IUPAC Name5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide
SMILESCCC(NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1)c1ccc(OC)cc1
InChIInChI=1S/C25H35N3O5S/c1-5-23(19-8-10-20(32-4)11-9-19)26-25(29)22-18-21(34(30,31)28(6-2)7-3)12-13-24(22)27-14-16-33-17-15-27/h8-13,18,23H,5-7,14-17H2,1-4H3,(H,26,29)
InChIKeyGJTSPZFFSFXRLO-UHFFFAOYSA-N
XLogP3.44
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.64
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-aminoethyl)-5-(diethylsulfamoyl)-2-morpholin-4-ylbenzamide;hydrochloride
CID 119383889
5-(diethylsulfamoyl)-N-(2,5-dimethylpyrazol-3-yl)-2-morpholin-4-ylbenzamide
CID 55669464
2-[[5-(dimethylsulfamoyl)-2-morpholin-4-ylbenzoyl]amino]butanoic acid
CID 119223365
5-(diethylsulfamoyl)-N-(1-ethyl-6-oxo-3-pyridinyl)-2-morpholin-4-ylbenzamide
CID 55990599
5-(diethylsulfamoyl)-N-methyl-N-(4-methylpentan-2-yl)-2-morpholin-4-ylbenzamide
CID 55591057
5-(diethylsulfamoyl)-N-(2-methylpropyl)-2-pyrrolidin-1-ylbenzamide
CID 51159074
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-methoxyacetamide
CID 24656898
(E)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-3-(3-methoxyphenyl)prop-2-enamide
CID 6219257
5-(diethylsulfamoyl)-2-fluoro-N-[1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 55395143
N-(4-chloro-3-cyanophenyl)-5-(diethylsulfamoyl)-2-morpholin-4-ylbenzamide
CID 55481130
N-[(1S)-1-(4-methoxyphenyl)propyl]-4-(morpholin-4-ylmethyl)benzamide
CID 28579988
5-(diethylsulfamoyl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-pyrrolidin-1-ylbenzamide
CID 9277220

Frequently Asked Questions

What is the IUPAC name of 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide?
The IUPAC name of 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide (CID 55371511) is 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide.
What is the SMILES notation for 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide?
The canonical SMILES for 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide is CCC(NC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1)c1ccc(OC)cc1.
What is the InChIKey of 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide?
The InChIKey is GJTSPZFFSFXRLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H35N3O5S/c1-5-23(19-8-10-20(32-4)11-9-19)26-25(29)22-18-21(34(30,31)28(6-2)7-3)12-13-24(22)27-14-16-33-17-15-27/h8-13,18,23H,5-7,14-17H2,1-4H3,(H,26,29).
What are the key properties of 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide?
5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide has a molecular weight of 489.64 g/mol, XLogP of 3.44, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylsulfamoyl)-N-[1-(4-methoxyphenyl)propyl]-2-morpholin-4-ylbenzamide is sourced from PubChem (CID 55371511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).