N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide

C15H17FN2O3S2 — CID 51335598

IUPACN-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide
SMILESO=S(=O)(NC(c1ccc(F)cc1)c1cccs1)N1CCOCC1
InChIInChI=1S/C15H17FN2O3S2/c16-13-5-3-12(4-6-13)15(14-2-1-11-22-14)17-23(19,20)18-7-9-21-10-8-18/h1-6,11,15,17H,7-10H2
InChIKeyJOIFFFNVINYDEC-UHFFFAOYSA-N
MW356.44 g/mol
LogP2.14
Rot. Bonds5

About N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide

N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide (PubChem CID 51335598) has the molecular formula C15H17FN2O3S2 and a molecular weight of 356.44 g/mol. Its IUPAC name is N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide
PubChem CID51335598
Molecular FormulaC15H17FN2O3S2
Molecular Weight356.44 g/mol
Exact Mass356.07
IUPAC NameN-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide
SMILESO=S(=O)(NC(c1ccc(F)cc1)c1cccs1)N1CCOCC1
InChIInChI=1S/C15H17FN2O3S2/c16-13-5-3-12(4-6-13)15(14-2-1-11-22-14)17-23(19,20)18-7-9-21-10-8-18/h1-6,11,15,17H,7-10H2
InChIKeyJOIFFFNVINYDEC-UHFFFAOYSA-N
XLogP2.14
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.44
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-thiophen-2-ylethyl)morpholine-4-sulfonamide
CID 47141625
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 46566179
N-[(S)-(4-fluorophenyl)-thiophen-2-ylmethyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 25388249
N-(1-thiophen-2-ylpropyl)morpholine-4-sulfonamide
CID 47306222
1-chloro-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]methanesulfonamide
CID 63665118
4-fluoro-N-[(1S,2R)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]benzenesulfonamide
CID 7110860
N-(4-fluorophenyl)morpholine-4-sulfonamide
CID 2978606
N-[(S)-(4-fluorophenyl)-thiophen-2-ylmethyl]acetamide
CID 41099331
1-(4-fluorophenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43393729
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-(trifluoromethyl)benzenesulfonamide
CID 43021402
1-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-[[3-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 60548774
N-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]morpholine-4-sulfonamide
CID 42937633

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide?
The IUPAC name of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide (CID 51335598) is N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide is O=S(=O)(NC(c1ccc(F)cc1)c1cccs1)N1CCOCC1.
What is the InChIKey of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide?
The InChIKey is JOIFFFNVINYDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O3S2/c16-13-5-3-12(4-6-13)15(14-2-1-11-22-14)17-23(19,20)18-7-9-21-10-8-18/h1-6,11,15,17H,7-10H2.
What are the key properties of N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide?
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide has a molecular weight of 356.44 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)-thiophen-2-ylmethyl]morpholine-4-sulfonamide is sourced from PubChem (CID 51335598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).