2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide

C14H18N2O4S2 — CID 71860079

IUPAC2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCC(C)c2ccsc2)c(C)o1
InChIInChI=1S/C14H18N2O4S2/c1-9(11-4-5-21-8-11)7-16-14(17)12-6-13(20-10(12)2)22(18,19)15-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17)
InChIKeyGDMIUAJDMLRPQS-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.09
Rot. Bonds6

About 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide

2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide (PubChem CID 71860079) has the molecular formula C14H18N2O4S2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide
PubChem CID71860079
Molecular FormulaC14H18N2O4S2
Molecular Weight342.44 g/mol
Exact Mass342.07
IUPAC Name2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCC(C)c2ccsc2)c(C)o1
InChIInChI=1S/C14H18N2O4S2/c1-9(11-4-5-21-8-11)7-16-14(17)12-6-13(20-10(12)2)22(18,19)15-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17)
InChIKeyGDMIUAJDMLRPQS-UHFFFAOYSA-N
XLogP2.09
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
CID 119507697
7-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]heptanoic acid
CID 119350785
N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2,5-dimethylbenzamide
CID 42549056
N-(2-amino-1-cyclopropylethyl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide;hydrochloride
CID 119615923
2,5-dimethyl-N-[2-methyl-3-(methylamino)propyl]furan-3-carboxamide
CID 81487603
2-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-ethyl-3-(2-thiophen-3-ylpropyl)guanidine
CID 111704166
2-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-ethyl-3-(2-thiophen-3-ylpropyl)guanidine;hydroiodide
CID 111704165
1,1,2-trimethyl-3-(2-thiophen-3-ylpropyl)guanidine
CID 111703330
1-ethyl-2-methyl-3-(2-thiophen-3-ylpropyl)guanidine
CID 111702778
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-methylsulfonylbenzamide
CID 33090690
N-[2-(diethylamino)-2-thiophen-3-ylethyl]-4-methoxy-3-(methylsulfamoyl)benzamide
CID 55660126
1-[[2-methyl-5-(methylsulfamoyl)furan-3-carbonyl]amino]cyclobutane-1-carboxylic acid
CID 120531056

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide?
The IUPAC name of 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide (CID 71860079) is 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide.
What is the SMILES notation for 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide?
The canonical SMILES for 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide is CNS(=O)(=O)c1cc(C(=O)NCC(C)c2ccsc2)c(C)o1.
What is the InChIKey of 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide?
The InChIKey is GDMIUAJDMLRPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4S2/c1-9(11-4-5-21-8-11)7-16-14(17)12-6-13(20-10(12)2)22(18,19)15-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17).
What are the key properties of 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide?
2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(methylsulfamoyl)-N-(2-thiophen-3-ylpropyl)furan-3-carboxamide is sourced from PubChem (CID 71860079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).