N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide

C9H6ClNO4S2 — CID 47108903

IUPACN-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccco1
InChIInChI=1S/C9H6ClNO4S2/c10-7-3-4-8(16-7)17(13,14)11-9(12)6-2-1-5-15-6/h1-5H,(H,11,12)
InChIKeyULWFJAZLHRBENR-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.11
Rot. Bonds3

About N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide

N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide (PubChem CID 47108903) has the molecular formula C9H6ClNO4S2 and a molecular weight of 291.74 g/mol. Its IUPAC name is N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide
PubChem CID47108903
Molecular FormulaC9H6ClNO4S2
Molecular Weight291.74 g/mol
Exact Mass290.94
IUPAC NameN-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide
SMILESO=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccco1
InChIInChI=1S/C9H6ClNO4S2/c10-7-3-4-8(16-7)17(13,14)11-9(12)6-2-1-5-15-6/h1-5H,(H,11,12)
InChIKeyULWFJAZLHRBENR-UHFFFAOYSA-N
XLogP2.11
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide?
The IUPAC name of N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide (CID 47108903) is N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide.
What is the SMILES notation for N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide?
The canonical SMILES for N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide is O=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccco1.
What is the InChIKey of N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide?
The InChIKey is ULWFJAZLHRBENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO4S2/c10-7-3-4-8(16-7)17(13,14)11-9(12)6-2-1-5-15-6/h1-5H,(H,11,12).
What are the key properties of N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide?
N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide is sourced from PubChem (CID 47108903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).