(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine

C14H14FN3O3S — CID 124978418

IUPAC(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
SMILESO=S(=O)(c1cccc(F)c1)N1CCO[C@@H](c2cnccn2)C1
InChIInChI=1S/C14H14FN3O3S/c15-11-2-1-3-12(8-11)22(19,20)18-6-7-21-14(10-18)13-9-16-4-5-17-13/h1-5,8-9,14H,6-7,10H2/t14-/m1/s1
InChIKeyLTSZNZSXSUBBCF-CQSZACIVSA-N
MW323.35 g/mol
LogP1.38
Rot. Bonds3

About (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine

(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine (PubChem CID 124978418) has the molecular formula C14H14FN3O3S and a molecular weight of 323.35 g/mol. Its IUPAC name is (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine.

Molecular Properties

Compound Name(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
PubChem CID124978418
Molecular FormulaC14H14FN3O3S
Molecular Weight323.35 g/mol
Exact Mass323.07
IUPAC Name(2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine
SMILESO=S(=O)(c1cccc(F)c1)N1CCO[C@@H](c2cnccn2)C1
InChIInChI=1S/C14H14FN3O3S/c15-11-2-1-3-12(8-11)22(19,20)18-6-7-21-14(10-18)13-9-16-4-5-17-13/h1-5,8-9,14H,6-7,10H2/t14-/m1/s1
InChIKeyLTSZNZSXSUBBCF-CQSZACIVSA-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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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The IUPAC name of (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine (CID 124978418) is (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine.
What is the SMILES notation for (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The canonical SMILES for (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine is O=S(=O)(c1cccc(F)c1)N1CCO[C@@H](c2cnccn2)C1.
What is the InChIKey of (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
The InChIKey is LTSZNZSXSUBBCF-CQSZACIVSA-N. The full InChI is InChI=1S/C14H14FN3O3S/c15-11-2-1-3-12(8-11)22(19,20)18-6-7-21-14(10-18)13-9-16-4-5-17-13/h1-5,8-9,14H,6-7,10H2/t14-/m1/s1.
What are the key properties of (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine?
(2R)-4-(3-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 (2R)-4-(3-fluorophenyl)sulfonyl-2-pyrazin-2-ylmorpholine is sourced from PubChem (CID 124978418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).