2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

C18H23ClN2O4S — CID 51187743

IUPAC2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NC(C)c2ccc(C)o2)c1
InChIInChI=1S/C18H23ClN2O4S/c1-5-21(6-2)26(23,24)14-8-9-16(19)15(11-14)18(22)20-13(4)17-10-7-12(3)25-17/h7-11,13H,5-6H2,1-4H3,(H,20,22)
InChIKeyYFGWEBMXHAOALX-UHFFFAOYSA-N
MW398.91 g/mol
LogP3.76
Rot. Bonds7

About 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (PubChem CID 51187743) has the molecular formula C18H23ClN2O4S and a molecular weight of 398.91 g/mol. Its IUPAC name is 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
PubChem CID51187743
Molecular FormulaC18H23ClN2O4S
Molecular Weight398.91 g/mol
Exact Mass398.11
IUPAC Name2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NC(C)c2ccc(C)o2)c1
InChIInChI=1S/C18H23ClN2O4S/c1-5-21(6-2)26(23,24)14-8-9-16(19)15(11-14)18(22)20-13(4)17-10-7-12(3)25-17/h7-11,13H,5-6H2,1-4H3,(H,20,22)
InChIKeyYFGWEBMXHAOALX-UHFFFAOYSA-N
XLogP3.76
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.91
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46680020
N-[(2R)-butan-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide
CID 2478774
N-tert-butyl-2-chloro-5-(diethylsulfamoyl)benzamide
CID 2404438
2-chloro-5-(diethylsulfamoyl)-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 55364133
2-chloro-N-[1-(5-methylfuran-2-yl)ethyl]-5-methylsulfanylbenzamide
CID 47110574
2-chloro-5-(diethylsulfamoyl)benzoate
CID 4206054
2-chloro-5-(diethylsulfamoyl)-N-(3-methylbutyl)benzamide
CID 2677242
2-chloro-5-(diethylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide
CID 26894506
2-chloro-5-(diethylsulfamoyl)-N-[1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethyl]benzamide
CID 60568577
2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
CID 86920765
2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide
CID 112765419
2,4-dichloro-5-(cyclopropylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 55371526

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The IUPAC name of 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (CID 51187743) is 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.
What is the SMILES notation for 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The canonical SMILES for 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NC(C)c2ccc(C)o2)c1.
What is the InChIKey of 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The InChIKey is YFGWEBMXHAOALX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClN2O4S/c1-5-21(6-2)26(23,24)14-8-9-16(19)15(11-14)18(22)20-13(4)17-10-7-12(3)25-17/h7-11,13H,5-6H2,1-4H3,(H,20,22).
What are the key properties of 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide has a molecular weight of 398.91 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(diethylsulfamoyl)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is sourced from PubChem (CID 51187743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).