2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide

C15H14FN5O3S — CID 90518653

IUPAC2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide
SMILESO=S(=O)(CCOc1ccc(F)cc1)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H14FN5O3S/c16-12-1-7-15(8-2-12)24-9-10-25(22,23)18-13-3-5-14(6-4-13)21-11-17-19-20-21/h1-8,11,18H,9-10H2
InChIKeyOLAIUBQWLBNUGS-UHFFFAOYSA-N
MW363.37 g/mol
LogP1.62
Rot. Bonds7

About 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide

2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide (PubChem CID 90518653) has the molecular formula C15H14FN5O3S and a molecular weight of 363.37 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide
PubChem CID90518653
Molecular FormulaC15H14FN5O3S
Molecular Weight363.37 g/mol
Exact Mass363.08
IUPAC Name2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide
SMILESO=S(=O)(CCOc1ccc(F)cc1)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H14FN5O3S/c16-12-1-7-15(8-2-12)24-9-10-25(22,23)18-13-3-5-14(6-4-13)21-11-17-19-20-21/h1-8,11,18H,9-10H2
InChIKeyOLAIUBQWLBNUGS-UHFFFAOYSA-N
XLogP1.62
TPSA99.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-fluorophenoxy)-N-[4-(trifluoromethyl)phenyl]ethanesulfonamide
CID 90518572
N-(4-bromophenyl)-2-(4-fluorophenoxy)ethanesulfonamide
CID 90518586
N-[2-(4-fluorophenoxy)ethyl]-4-(tetrazol-1-yl)benzamide
CID 37363321
1-(4-fluorophenyl)tetrazole
CID 825628
4-[2-(4-fluorophenoxy)ethylsulfonylamino]-N-pyrimidin-2-ylbenzenesulfonamide
CID 90518562
2-(4-fluorophenoxy)-N-(6-methoxy-3-pyridinyl)ethanesulfonamide
CID 110301907
N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-fluorophenoxy)ethanesulfonamide
CID 110618586
N-[4-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-fluorophenoxy)ethanesulfonamide
CID 121107548
2-[(4-fluorophenoxy)methyl]-N-[4-(tetrazol-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 24672202
2-[2-[4-(tetrazol-1-yl)phenoxy]ethyl]isoindole-1,3-dione
CID 8566135
[4-(tetrazol-1-yl)phenyl] trifluoromethanesulfonate
CID 88559232
N-[3,5-bis(trifluoromethyl)phenyl]-4-(tetrazol-1-yl)benzenesulfonamide
CID 166204102

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide (CID 90518653) is 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide is O=S(=O)(CCOc1ccc(F)cc1)Nc1ccc(-n2cnnn2)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide?
The InChIKey is OLAIUBQWLBNUGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN5O3S/c16-12-1-7-15(8-2-12)24-9-10-25(22,23)18-13-3-5-14(6-4-13)21-11-17-19-20-21/h1-8,11,18H,9-10H2.
What are the key properties of 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide?
2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide has a molecular weight of 363.37 g/mol, XLogP of 1.62, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-[4-(tetrazol-1-yl)phenyl]ethanesulfonamide is sourced from PubChem (CID 90518653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).