3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide

C16H16F2N2O3S — CID 17442409

IUPAC3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(F)cc(F)c1
InChIInChI=1S/C16H16F2N2O3S/c17-12-9-13(18)11-14(10-12)24(21,22)19-15-3-1-2-4-16(15)20-5-7-23-8-6-20/h1-4,9-11,19H,5-8H2
InChIKeyADZXSNAZPYRMNL-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.60
Rot. Bonds4

About 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide

3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide (PubChem CID 17442409) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
PubChem CID17442409
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC Name3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(F)cc(F)c1
InChIInChI=1S/C16H16F2N2O3S/c17-12-9-13(18)11-14(10-12)24(21,22)19-15-3-1-2-4-16(15)20-5-7-23-8-6-20/h1-4,9-11,19H,5-8H2
InChIKeyADZXSNAZPYRMNL-UHFFFAOYSA-N
XLogP2.60
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 2444334
4-[2-(sulfamoylamino)phenyl]morpholine
CID 112573552
sodium N-(2-morpholin-4-ylphenyl)sulfamate
CID 174221479
N-(2-morpholin-4-ylphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 4794707
N-(5-fluoro-2-morpholin-4-ylphenyl)-4-methylbenzenesulfonamide
CID 113092748
3-[(4-fluorophenyl)sulfonylamino]-4-morpholin-4-ylbenzoic acid
CID 46292418
3,4-dimethyl-5-[(2-morpholin-4-ylphenyl)sulfamoyl]benzoic acid
CID 4806596
4-N,4-N-dimethyl-1-N-[2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]phenyl]benzene-1,4-disulfonamide
CID 165388902
2-fluoro-N-(2-morpholin-4-ylphenyl)-5-(propan-2-ylsulfamoyl)benzamide
CID 55604676
4-bromo-N-(2-piperidin-1-ylphenyl)benzenesulfonamide
CID 2435475
N-(5-fluoro-2-morpholin-4-ylphenyl)ethanesulfonamide
CID 113092743
2,4-difluoro-N-(2-morpholin-4-ylphenyl)benzamide
CID 3662242

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The IUPAC name of 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide (CID 17442409) is 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide.
What is the SMILES notation for 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The canonical SMILES for 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1N1CCOCC1)c1cc(F)cc(F)c1.
What is the InChIKey of 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The InChIKey is ADZXSNAZPYRMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c17-12-9-13(18)11-14(10-12)24(21,22)19-15-3-1-2-4-16(15)20-5-7-23-8-6-20/h1-4,9-11,19H,5-8H2.
What are the key properties of 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide has a molecular weight of 354.38 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(2-morpholin-4-ylphenyl)benzenesulfonamide is sourced from PubChem (CID 17442409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).