3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide

C15H18N2O4S — CID 4824191

IUPAC3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide
SMILESCN(Cc1ccco1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C15H18N2O4S/c1-16(2)22(19,20)14-8-4-6-12(10-14)15(18)17(3)11-13-7-5-9-21-13/h4-10H,11H2,1-3H3
InChIKeyMNZFAKBBWSBLJB-UHFFFAOYSA-N
MW322.39 g/mol
LogP1.80
Rot. Bonds5

About 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide

3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide (PubChem CID 4824191) has the molecular formula C15H18N2O4S and a molecular weight of 322.39 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide
PubChem CID4824191
Molecular FormulaC15H18N2O4S
Molecular Weight322.39 g/mol
Exact Mass322.10
IUPAC Name3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide
SMILESCN(Cc1ccco1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C15H18N2O4S/c1-16(2)22(19,20)14-8-4-6-12(10-14)15(18)17(3)11-13-7-5-9-21-13/h4-10H,11H2,1-3H3
InChIKeyMNZFAKBBWSBLJB-UHFFFAOYSA-N
XLogP1.80
TPSA70.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-3-(dimethylsulfamoyl)-N-methylbenzamide
CID 26731707
N-(furan-2-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 26711931
3-(dimethylsulfamoyl)-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzamide
CID 17471417
N-[2-(dimethylamino)-2-oxoethyl]-3-(dimethylsulfamoyl)-N-methylbenzamide
CID 9226973
3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(furan-2-ylmethyl)-N-methylbenzamide
CID 27739609
[2-[furan-2-ylmethyl(methyl)amino]-2-oxoethyl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate
CID 30563009
N-cyclopropyl-N-(furan-2-ylmethyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 46582047
2-[[3-(dimethylsulfamoyl)benzoyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 95295267
N-(furan-2-ylmethyl)-N-methyl-9-oxofluorene-2-carboxamide
CID 24615704
N-(furan-2-ylmethyl)-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763376
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 31150760
3-(dimethylsulfamoyl)-N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 38072733

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide (CID 4824191) is 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide is CN(Cc1ccco1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide?
The InChIKey is MNZFAKBBWSBLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S/c1-16(2)22(19,20)14-8-4-6-12(10-14)15(18)17(3)11-13-7-5-9-21-13/h4-10H,11H2,1-3H3.
What are the key properties of 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide?
3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide has a molecular weight of 322.39 g/mol, XLogP of 1.80, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylbenzamide is sourced from PubChem (CID 4824191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).