N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide

C23H31F2N3O5S — CID 55330865

IUPACN-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide
SMILESCCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1OC(F)F
InChIInChI=1S/C23H31F2N3O5S/c1-6-27(7-2)19-14-13-16(34(30,31)28(8-3)9-4)15-18(19)26-22(29)17-11-10-12-20(32-5)21(17)33-23(24)25/h10-15,23H,6-9H2,1-5H3,(H,26,29)
InChIKeyQDLAYSBKXWFPPZ-UHFFFAOYSA-N
MW499.58 g/mol
LogP4.43
Rot. Bonds12

About N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide

N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide (PubChem CID 55330865) has the molecular formula C23H31F2N3O5S and a molecular weight of 499.58 g/mol. Its IUPAC name is N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide
PubChem CID55330865
Molecular FormulaC23H31F2N3O5S
Molecular Weight499.58 g/mol
Exact Mass499.20
IUPAC NameN-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide
SMILESCCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1OC(F)F
InChIInChI=1S/C23H31F2N3O5S/c1-6-27(7-2)19-14-13-16(34(30,31)28(8-3)9-4)15-18(19)26-22(29)17-11-10-12-20(32-5)21(17)33-23(24)25/h10-15,23H,6-9H2,1-5H3,(H,26,29)
InChIKeyQDLAYSBKXWFPPZ-UHFFFAOYSA-N
XLogP4.43
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500499.58
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 4830026
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2,6-dimethoxybenzamide
CID 3482622
2-(difluoromethoxy)-3-methoxy-N-naphthalen-1-ylbenzamide
CID 112762767
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2,3-dimethylbenzamide
CID 9467095
N-[3-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)benzamide
CID 8883724
3-(diethylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 4003550
2-[2-(diethylamino)-5-(diethylsulfamoyl)anilino]-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 55409476
N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-methylbutanamide
CID 46511241
5-(diethylsulfamoyl)-N-(2-methoxyphenyl)-2-methylbenzamide
CID 2994373
2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide
CID 51143865
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2,6-difluorobenzamide
CID 26901213
N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]pyridine-2-carboxamide
CID 26880756

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide?
The IUPAC name of N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide (CID 55330865) is N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide.
What is the SMILES notation for N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide?
The canonical SMILES for N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide is CCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1OC(F)F.
What is the InChIKey of N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide?
The InChIKey is QDLAYSBKXWFPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31F2N3O5S/c1-6-27(7-2)19-14-13-16(34(30,31)28(8-3)9-4)15-18(19)26-22(29)17-11-10-12-20(32-5)21(17)33-23(24)25/h10-15,23H,6-9H2,1-5H3,(H,26,29).
What are the key properties of N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide?
N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide has a molecular weight of 499.58 g/mol, XLogP of 4.43, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide is sourced from PubChem (CID 55330865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).