N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

C20H28N2O4S — CID 39482925

IUPACN-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESCCC(CC)CN(CC)C(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C20H28N2O4S/c1-4-16(5-2)15-22(6-3)20(23)17-9-11-19(12-10-17)27(24,25)21-14-18-8-7-13-26-18/h7-13,16,21H,4-6,14-15H2,1-3H3
InChIKeyLKVVOKRSYAMMRM-UHFFFAOYSA-N
MW392.52 g/mol
LogP3.66
Rot. Bonds10

About N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide

N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (PubChem CID 39482925) has the molecular formula C20H28N2O4S and a molecular weight of 392.52 g/mol. Its IUPAC name is N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
PubChem CID39482925
Molecular FormulaC20H28N2O4S
Molecular Weight392.52 g/mol
Exact Mass392.18
IUPAC NameN-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
SMILESCCC(CC)CN(CC)C(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1
InChIInChI=1S/C20H28N2O4S/c1-4-16(5-2)15-22(6-3)20(23)17-9-11-19(12-10-17)27(24,25)21-14-18-8-7-13-26-18/h7-13,16,21H,4-6,14-15H2,1-3H3
InChIKeyLKVVOKRSYAMMRM-UHFFFAOYSA-N
XLogP3.66
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.52
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[4-(furan-2-ylmethylsulfamoyl)benzoyl]amino]butanoic acid
CID 119223860
N-(furan-2-ylmethyl)-4-(furan-2-ylmethylsulfamoyl)-N-prop-2-ynylbenzamide
CID 47083523
N,N-diethyl-4-[4-(furan-2-ylmethylsulfamoyl)benzoyl]piperazine-1-carboxamide
CID 38719587
N-ethyl-N-(2-ethylbutyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 39482944
3-[ethyl-[5-(furan-2-ylmethylsulfamoyl)-2-methylbenzoyl]amino]-2-methylpropanoic acid
CID 75429428
4-(furan-2-ylmethylsulfamoyl)-N-(2-phenylbutyl)benzamide
CID 24548503
3-(furan-2-ylmethylsulfamoyl)-N,N-dipropylbenzamide
CID 109064446
N-(furan-2-ylmethyl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 17490399
3-oxobutan-2-yl 4-(furan-2-ylmethylsulfamoyl)benzoate
CID 45353023
N-[2-(4-chlorophenyl)ethyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 9217544
4-(furan-2-ylmethylsulfamoyl)-N-[(4-methoxyphenyl)methyl]-N-methylbenzamide
CID 24547189
4-(furan-2-ylmethylsulfamoyl)-N-methyl-N-(2-phenoxyethyl)benzamide
CID 2555092

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide (CID 39482925) is N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is CCC(CC)CN(CC)C(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1.
What is the InChIKey of N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is LKVVOKRSYAMMRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O4S/c1-4-16(5-2)15-22(6-3)20(23)17-9-11-19(12-10-17)27(24,25)21-14-18-8-7-13-26-18/h7-13,16,21H,4-6,14-15H2,1-3H3.
What are the key properties of N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide?
N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 392.52 g/mol, XLogP of 3.66, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-ethylbutyl)-4-(furan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 39482925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).