N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide

C10H13FN2O4S — CID 64794956

IUPACN-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1O)N1CCOCC1
InChIInChI=1S/C10H13FN2O4S/c11-8-1-2-10(14)9(7-8)12-18(15,16)13-3-5-17-6-4-13/h1-2,7,12,14H,3-6H2
InChIKeyLLAPKDCBPDTJDX-UHFFFAOYSA-N
MW276.29 g/mol
LogP0.52
Rot. Bonds3

About N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide

N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide (PubChem CID 64794956) has the molecular formula C10H13FN2O4S and a molecular weight of 276.29 g/mol. Its IUPAC name is N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide
PubChem CID64794956
Molecular FormulaC10H13FN2O4S
Molecular Weight276.29 g/mol
Exact Mass276.06
IUPAC NameN-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1O)N1CCOCC1
InChIInChI=1S/C10H13FN2O4S/c11-8-1-2-10(14)9(7-8)12-18(15,16)13-3-5-17-6-4-13/h1-2,7,12,14H,3-6H2
InChIKeyLLAPKDCBPDTJDX-UHFFFAOYSA-N
XLogP0.52
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(4-fluorophenyl)morpholine-4-sulfonamide
CID 2978606
N-(2-hydroxy-4-methylphenyl)morpholine-4-sulfonamide
CID 43436716
N-(2,5-dihydroxyphenyl)pyrrolidine-1-sulfonamide
CID 154467539
3-hydroxy-4-(morpholin-4-ylsulfonylamino)benzoic acid
CID 60827859
N-(2-fluorophenyl)morpholine-4-sulfonamide
CID 110706019
3-fluoro-4-(morpholin-4-ylsulfonylamino)benzoic acid
CID 63189853
N-(4-bromo-2-fluorophenyl)morpholine-4-sulfonamide
CID 28785168
3-fluoro-N-[4-hydroxy-3-(morpholin-4-ylsulfonylamino)phenyl]-4-phenylbenzamide
CID 175830759
N-(4-hydroxyphenyl)morpholine-4-sulfonamide
CID 21238314
N-(5-fluoro-2-hydroxyphenyl)propane-2-sulfonamide
CID 64794598
N-(5-fluoro-2-hydroxyphenyl)cyclopentanesulfonamide
CID 105361240
N-(4-chloro-2-methylphenyl)morpholine-4-sulfonamide
CID 110706024

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide?
The IUPAC name of N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide (CID 64794956) is N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide?
The canonical SMILES for N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide is O=S(=O)(Nc1cc(F)ccc1O)N1CCOCC1.
What is the InChIKey of N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide?
The InChIKey is LLAPKDCBPDTJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O4S/c11-8-1-2-10(14)9(7-8)12-18(15,16)13-3-5-17-6-4-13/h1-2,7,12,14H,3-6H2.
What are the key properties of N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide?
N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide has a molecular weight of 276.29 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-hydroxyphenyl)morpholine-4-sulfonamide is sourced from PubChem (CID 64794956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).