5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide

C14H19N3O4S2 — CID 126784875

IUPAC5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCCc2csc(C(C)C)n2)co1
InChIInChI=1S/C14H19N3O4S2/c1-9(2)14-17-11(8-22-14)4-5-16-13(18)10-6-12(21-7-10)23(19,20)15-3/h6-9,15H,4-5H2,1-3H3,(H,16,18)
InChIKeyGCVMUAFFIOCQMM-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.74
Rot. Bonds7

About 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide

5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide (PubChem CID 126784875) has the molecular formula C14H19N3O4S2 and a molecular weight of 357.46 g/mol. Its IUPAC name is 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide
PubChem CID126784875
Molecular FormulaC14H19N3O4S2
Molecular Weight357.46 g/mol
Exact Mass357.08
IUPAC Name5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NCCc2csc(C(C)C)n2)co1
InChIInChI=1S/C14H19N3O4S2/c1-9(2)14-17-11(8-22-14)4-5-16-13(18)10-6-12(21-7-10)23(19,20)15-3/h6-9,15H,4-5H2,1-3H3,(H,16,18)
InChIKeyGCVMUAFFIOCQMM-UHFFFAOYSA-N
XLogP1.74
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide?
The IUPAC name of 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide (CID 126784875) is 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide.
What is the SMILES notation for 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide?
The canonical SMILES for 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide is CNS(=O)(=O)c1cc(C(=O)NCCc2csc(C(C)C)n2)co1.
What is the InChIKey of 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide?
The InChIKey is GCVMUAFFIOCQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O4S2/c1-9(2)14-17-11(8-22-14)4-5-16-13(18)10-6-12(21-7-10)23(19,20)15-3/h6-9,15H,4-5H2,1-3H3,(H,16,18).
What are the key properties of 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide?
5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 1.74, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylsulfamoyl)-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 126784875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).