N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide

C16H15NO3S2 — CID 71804111

IUPACN-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(Cc1ccoc1)Cc1cccs1
InChIInChI=1S/C16H15NO3S2/c18-22(19,16-6-2-1-3-7-16)17(11-14-8-9-20-13-14)12-15-5-4-10-21-15/h1-10,13H,11-12H2
InChIKeyRGGPGLLERNVNQG-UHFFFAOYSA-N
MW333.43 g/mol
LogP3.73
Rot. Bonds6

About N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide

N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide (PubChem CID 71804111) has the molecular formula C16H15NO3S2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide
PubChem CID71804111
Molecular FormulaC16H15NO3S2
Molecular Weight333.43 g/mol
Exact Mass333.05
IUPAC NameN-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(Cc1ccoc1)Cc1cccs1
InChIInChI=1S/C16H15NO3S2/c18-22(19,16-6-2-1-3-7-16)17(11-14-8-9-20-13-14)12-15-5-4-10-21-15/h1-10,13H,11-12H2
InChIKeyRGGPGLLERNVNQG-UHFFFAOYSA-N
XLogP3.73
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The IUPAC name of N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide (CID 71804111) is N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide.
What is the SMILES notation for N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The canonical SMILES for N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide is O=S(=O)(c1ccccc1)N(Cc1ccoc1)Cc1cccs1.
What is the InChIKey of N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The InChIKey is RGGPGLLERNVNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3S2/c18-22(19,16-6-2-1-3-7-16)17(11-14-8-9-20-13-14)12-15-5-4-10-21-15/h1-10,13H,11-12H2.
What are the key properties of N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide has a molecular weight of 333.43 g/mol, XLogP of 3.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 71804111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).