2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine

C14H13FN2O3S — CID 122247334

IUPAC2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine
SMILESO=S(=O)(c1ccc(F)cc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C14H13FN2O3S/c15-11-4-6-13(7-5-11)21(18,19)17-9-12(10-17)20-14-3-1-2-8-16-14/h1-8,12H,9-10H2
InChIKeyNLRNMCCFCFYLQF-UHFFFAOYSA-N
MW308.33 g/mol
LogP1.67
Rot. Bonds4

About 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine

2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine (PubChem CID 122247334) has the molecular formula C14H13FN2O3S and a molecular weight of 308.33 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine
PubChem CID122247334
Molecular FormulaC14H13FN2O3S
Molecular Weight308.33 g/mol
Exact Mass308.06
IUPAC Name2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine
SMILESO=S(=O)(c1ccc(F)cc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C14H13FN2O3S/c15-11-4-6-13(7-5-11)21(18,19)17-9-12(10-17)20-14-3-1-2-8-16-14/h1-8,12H,9-10H2
InChIKeyNLRNMCCFCFYLQF-UHFFFAOYSA-N
XLogP1.67
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine
CID 122247345
5-chloro-2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine
CID 122248528
2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine-4-carbonitrile
CID 122252604
2-[(3R)-1-(3,4-difluorophenyl)sulfonylpyrrolidin-3-yl]oxypyridine
CID 129416787
4-(3-pyridin-2-yloxypiperidin-1-yl)sulfonylaniline
CID 89245431
2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxy-1,3-thiazole
CID 90627703
4-N-(4-fluorophenyl)-2-N-[4-(4-pyridin-2-yloxypiperidin-1-yl)sulfonylphenyl]pyrimidine-2,4-diamine
CID 59274788
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247174
2-[1-(5-methylthiophen-2-yl)sulfonylazetidin-3-yl]oxypyridine
CID 122247367
(3R,5R)-1-(4-fluorophenyl)sulfonyl-3,5-dimethylpiperidine
CID 755984
2-[1-(4-chlorophenyl)sulfonylazetidin-3-yl]oxy-6-(trifluoromethyl)pyridine
CID 122252095
1-(4-fluorophenyl)sulfonylazetidin-3-ol
CID 63106433

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine?
The IUPAC name of 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine (CID 122247334) is 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine.
What is the SMILES notation for 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine?
The canonical SMILES for 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine is O=S(=O)(c1ccc(F)cc1)N1CC(Oc2ccccn2)C1.
What is the InChIKey of 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine?
The InChIKey is NLRNMCCFCFYLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3S/c15-11-4-6-13(7-5-11)21(18,19)17-9-12(10-17)20-14-3-1-2-8-16-14/h1-8,12H,9-10H2.
What are the key properties of 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine?
2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine has a molecular weight of 308.33 g/mol, XLogP of 1.67, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine is sourced from PubChem (CID 122247334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).