2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide

C14H15FN2O4S — CID 110301907

IUPAC2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)CCOc2ccc(F)cc2)cn1
InChIInChI=1S/C14H15FN2O4S/c1-20-14-7-4-12(10-16-14)17-22(18,19)9-8-21-13-5-2-11(15)3-6-13/h2-7,10,17H,8-9H2,1H3
InChIKeyIHSCJEYSTCCVKV-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.05
Rot. Bonds7

About 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide

2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide (PubChem CID 110301907) has the molecular formula C14H15FN2O4S and a molecular weight of 326.35 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
PubChem CID110301907
Molecular FormulaC14H15FN2O4S
Molecular Weight326.35 g/mol
Exact Mass326.07
IUPAC Name2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)CCOc2ccc(F)cc2)cn1
InChIInChI=1S/C14H15FN2O4S/c1-20-14-7-4-12(10-16-14)17-22(18,19)9-8-21-13-5-2-11(15)3-6-13/h2-7,10,17H,8-9H2,1H3
InChIKeyIHSCJEYSTCCVKV-UHFFFAOYSA-N
XLogP2.05
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-fluorophenoxy)-N-(3,4,5-trimethoxyphenyl)ethanesulfonamide
CID 110299951
N-(4-bromophenyl)-2-(4-fluorophenoxy)ethanesulfonamide
CID 90518586
2-(4-fluorophenoxy)-N-[4-(trifluoromethyl)phenyl]ethanesulfonamide
CID 90518572
4-[2-(4-fluorophenoxy)ethylsulfonylamino]-N-pyrimidin-2-ylbenzenesulfonamide
CID 90518562
N-[6-(2-methoxyethoxy)-3-pyridinyl]propane-1-sulfonamide
CID 64591758
2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide
CID 90518653
N-(3,5-dimethoxyphenyl)-2-phenoxyethanesulfonamide
CID 90518196
2-methoxy-5-(sulfamoylamino)pyridine
CID 112573201
4-[2-(4-methoxyphenoxy)ethylsulfonylamino]benzenesulfonamide
CID 90518362
N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-fluorophenoxy)ethanesulfonamide
CID 110618586
4-(cyclopropylamino)-N-(6-methoxy-3-pyridinyl)butane-1-sulfonamide
CID 106059988
N-[2-(4-fluorophenyl)ethyl]-2-(4-methoxyphenoxy)ethanesulfonamide
CID 90518502

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide (CID 110301907) is 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide is COc1ccc(NS(=O)(=O)CCOc2ccc(F)cc2)cn1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide?
The InChIKey is IHSCJEYSTCCVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O4S/c1-20-14-7-4-12(10-16-14)17-22(18,19)9-8-21-13-5-2-11(15)3-6-13/h2-7,10,17H,8-9H2,1H3.
What are the key properties of 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide?
2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide has a molecular weight of 326.35 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide is sourced from PubChem (CID 110301907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).