N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide

C7H9F2NO4S — CID 154841394

IUPACN-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide
SMILESO=S(=O)(NCC(F)(F)CO)c1ccco1
InChIInChI=1S/C7H9F2NO4S/c8-7(9,5-11)4-10-15(12,13)6-2-1-3-14-6/h1-3,10-11H,4-5H2
InChIKeyQYEWFGRNNKCEAO-UHFFFAOYSA-N
MW241.22 g/mol
LogP0.19
Rot. Bonds5

About N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide

N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide (PubChem CID 154841394) has the molecular formula C7H9F2NO4S and a molecular weight of 241.22 g/mol. Its IUPAC name is N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide.

Molecular Properties

Compound NameN-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide
PubChem CID154841394
Molecular FormulaC7H9F2NO4S
Molecular Weight241.22 g/mol
Exact Mass241.02
IUPAC NameN-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide
SMILESO=S(=O)(NCC(F)(F)CO)c1ccco1
InChIInChI=1S/C7H9F2NO4S/c8-7(9,5-11)4-10-15(12,13)6-2-1-3-14-6/h1-3,10-11H,4-5H2
InChIKeyQYEWFGRNNKCEAO-UHFFFAOYSA-N
XLogP0.19
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.22
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide?
The IUPAC name of N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide (CID 154841394) is N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide.
What is the SMILES notation for N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide?
The canonical SMILES for N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide is O=S(=O)(NCC(F)(F)CO)c1ccco1.
What is the InChIKey of N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide?
The InChIKey is QYEWFGRNNKCEAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2NO4S/c8-7(9,5-11)4-10-15(12,13)6-2-1-3-14-6/h1-3,10-11H,4-5H2.
What are the key properties of N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide?
N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide has a molecular weight of 241.22 g/mol, XLogP of 0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoro-3-hydroxypropyl)furan-2-sulfonamide is sourced from PubChem (CID 154841394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).