4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine

C14H14FN3O3S — CID 127246296

IUPAC4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
SMILESO=S(=O)(c1ccccc1F)N1CCOC(c2cnccn2)C1
InChIInChI=1S/C14H14FN3O3S/c15-11-3-1-2-4-14(11)22(19,20)18-7-8-21-13(10-18)12-9-16-5-6-17-12/h1-6,9,13H,7-8,10H2
InChIKeyMERTWXJNKJMLFI-UHFFFAOYSA-N
MW323.35 g/mol
LogP1.38
Rot. Bonds3

About 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine

4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine (PubChem CID 127246296) has the molecular formula C14H14FN3O3S and a molecular weight of 323.35 g/mol. Its IUPAC name is 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine.

Molecular Properties

Compound Name4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
PubChem CID127246296
Molecular FormulaC14H14FN3O3S
Molecular Weight323.35 g/mol
Exact Mass323.07
IUPAC Name4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
SMILESO=S(=O)(c1ccccc1F)N1CCOC(c2cnccn2)C1
InChIInChI=1S/C14H14FN3O3S/c15-11-3-1-2-4-14(11)22(19,20)18-7-8-21-13(10-18)12-9-16-5-6-17-12/h1-6,9,13H,7-8,10H2
InChIKeyMERTWXJNKJMLFI-UHFFFAOYSA-N
XLogP1.38
TPSA72.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
CID 124978418
4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
CID 127246297
2-pyrazin-2-yl-4-thiophen-2-ylsulfonylmorpholine
CID 127246278
(2R)-2-pyrazin-2-yl-4-thiophen-2-ylsulfonylmorpholine
CID 124961088
(2R)-4-benzylsulfonyl-2-pyrazin-2-ylmorpholine
CID 124960005
(2S)-4-benzylsulfonyl-2-pyrazin-2-ylmorpholine
CID 124960004
N-[6-[(2R)-4-(2-chlorophenyl)sulfonylmorpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 124974476
(2,6-difluorophenyl)-[(2S)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124986914
4-(benzenesulfonyl)-2-pyridin-2-ylmorpholine
CID 110270736
6-[(2R)-4-(2-chlorophenyl)sulfonylmorpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 124996771
2-[(3S)-1-(2-methylphenyl)sulfonylpiperidin-3-yl]pyrazine
CID 95829531
4-(2-methylphenyl)sulfonyl-2-(4-methylpyrimidin-2-yl)morpholine
CID 110115458

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The IUPAC name of 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine (CID 127246296) is 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine.
What is the SMILES notation for 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The canonical SMILES for 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine is O=S(=O)(c1ccccc1F)N1CCOC(c2cnccn2)C1.
What is the InChIKey of 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The InChIKey is MERTWXJNKJMLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O3S/c15-11-3-1-2-4-14(11)22(19,20)18-7-8-21-13(10-18)12-9-16-5-6-17-12/h1-6,9,13H,7-8,10H2.
What are the key properties of 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine has a molecular weight of 323.35 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine is sourced from PubChem (CID 127246296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).