N-(furan-2-ylmethyl)-4-sulfamoylbenzamide

C12H12N2O4S — CID 10356308

IUPACN-(furan-2-ylmethyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)NCc2ccco2)cc1
InChIInChI=1S/C12H12N2O4S/c13-19(16,17)11-5-3-9(4-6-11)12(15)14-8-10-2-1-7-18-10/h1-7H,8H2,(H,14,15)(H2,13,16,17)
InChIKeyFYPREBIDXQCQJJ-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.86
Rot. Bonds4

About N-(furan-2-ylmethyl)-4-sulfamoylbenzamide

N-(furan-2-ylmethyl)-4-sulfamoylbenzamide (PubChem CID 10356308) has the molecular formula C12H12N2O4S and a molecular weight of 280.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-sulfamoylbenzamide
PubChem CID10356308
Molecular FormulaC12H12N2O4S
Molecular Weight280.31 g/mol
Exact Mass280.05
IUPAC NameN-(furan-2-ylmethyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)NCc2ccco2)cc1
InChIInChI=1S/C12H12N2O4S/c13-19(16,17)11-5-3-9(4-6-11)12(15)14-8-10-2-1-7-18-10/h1-7H,8H2,(H,14,15)(H2,13,16,17)
InChIKeyFYPREBIDXQCQJJ-UHFFFAOYSA-N
XLogP0.86
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984
4-(diethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
CID 2596785
N-(furan-2-ylmethyl)-2-methyl-5-sulfamoylbenzamide
CID 24539616
N-[[1-[1-(furan-2-ylmethylamino)-3-methyl-1-oxobutan-2-yl]triazol-4-yl]methyl]-4-sulfamoylbenzamide
CID 59621002
4-(benzenesulfonamido)-N-(furan-2-ylmethyl)benzamide
CID 2982615
N-(furan-2-ylmethyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 51297863
4-(chloromethyl)-N-(furan-2-ylmethyl)benzamide
CID 43156226
N-(furan-2-ylmethyl)-4-(3-methoxypropylsulfamoyl)benzamide
CID 109059880
4-[[(4-tert-butylphenyl)sulfonylamino]methyl]-N-(furan-2-ylmethyl)benzamide
CID 1300203
4-[(2-fluorophenyl)methylsulfamoyl]-N-(furan-2-ylmethyl)benzamide
CID 109060490
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
1-N-(furan-2-ylmethyl)-4-N-phenylbenzene-1,4-dicarboxamide
CID 109046573

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-sulfamoylbenzamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-sulfamoylbenzamide (CID 10356308) is N-(furan-2-ylmethyl)-4-sulfamoylbenzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-sulfamoylbenzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-sulfamoylbenzamide is NS(=O)(=O)c1ccc(C(=O)NCc2ccco2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-sulfamoylbenzamide?
The InChIKey is FYPREBIDXQCQJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4S/c13-19(16,17)11-5-3-9(4-6-11)12(15)14-8-10-2-1-7-18-10/h1-7H,8H2,(H,14,15)(H2,13,16,17).
What are the key properties of N-(furan-2-ylmethyl)-4-sulfamoylbenzamide?
N-(furan-2-ylmethyl)-4-sulfamoylbenzamide has a molecular weight of 280.31 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-sulfamoylbenzamide is sourced from PubChem (CID 10356308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).