4-(4-fluorophenyl)sulfonyl-2-methylmorpholine

C11H14FNO3S — CID 43388105

IUPAC4-(4-fluorophenyl)sulfonyl-2-methylmorpholine
SMILESCC1CN(S(=O)(=O)c2ccc(F)cc2)CCO1
InChIInChI=1S/C11H14FNO3S/c1-9-8-13(6-7-16-9)17(14,15)11-4-2-10(12)3-5-11/h2-5,9H,6-8H2,1H3
InChIKeyLEWGCCIFRIJRNU-UHFFFAOYSA-N
MW259.30 g/mol
LogP1.24
Rot. Bonds2

About 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine

4-(4-fluorophenyl)sulfonyl-2-methylmorpholine (PubChem CID 43388105) has the molecular formula C11H14FNO3S and a molecular weight of 259.30 g/mol. Its IUPAC name is 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine.

Molecular Properties

Compound Name4-(4-fluorophenyl)sulfonyl-2-methylmorpholine
PubChem CID43388105
Molecular FormulaC11H14FNO3S
Molecular Weight259.30 g/mol
Exact Mass259.07
IUPAC Name4-(4-fluorophenyl)sulfonyl-2-methylmorpholine
SMILESCC1CN(S(=O)(=O)c2ccc(F)cc2)CCO1
InChIInChI=1S/C11H14FNO3S/c1-9-8-13(6-7-16-9)17(14,15)11-4-2-10(12)3-5-11/h2-5,9H,6-8H2,1H3
InChIKeyLEWGCCIFRIJRNU-UHFFFAOYSA-N
XLogP1.24
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methylmorpholin-4-yl)sulfonylbenzoic acid
CID 18072868
4-(4-fluoro-3-methylphenyl)sulfonyl-2-methylmorpholine
CID 52985823
4-(2-methylmorpholin-4-yl)sulfonylbenzonitrile
CID 24692962
4-[4-(2-bromoethyl)phenyl]sulfonyl-2-methylmorpholine
CID 110313837
N-methyl-1-[4-(2-methylmorpholin-4-yl)sulfonylphenyl]methanamine
CID 60822203
4-(2-bromo-4-fluorophenyl)sulfonyl-2-methylmorpholine
CID 47257439
[2-fluoro-5-(2-methylmorpholin-4-yl)sulfonylphenyl]methanamine
CID 55171349
azepan-1-yl-[4-(2-methylmorpholin-4-yl)sulfonylphenyl]methanone
CID 110343797
4-[(2-methyl-1,4-oxazepan-4-yl)sulfonyl]phenol
CID 62968856
1-(4-fluorophenyl)sulfonyl-3-methylpyrrolidine
CID 61224457
2-methyl-5-(2-methylmorpholin-4-yl)sulfonylaniline
CID 43104694
4-(2-methylmorpholin-4-yl)sulfonyl-N-propan-2-ylbenzamide
CID 110343753

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine?
The IUPAC name of 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine (CID 43388105) is 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine.
What is the SMILES notation for 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine?
The canonical SMILES for 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine is CC1CN(S(=O)(=O)c2ccc(F)cc2)CCO1.
What is the InChIKey of 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine?
The InChIKey is LEWGCCIFRIJRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO3S/c1-9-8-13(6-7-16-9)17(14,15)11-4-2-10(12)3-5-11/h2-5,9H,6-8H2,1H3.
What are the key properties of 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine?
4-(4-fluorophenyl)sulfonyl-2-methylmorpholine has a molecular weight of 259.30 g/mol, XLogP of 1.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)sulfonyl-2-methylmorpholine is sourced from PubChem (CID 43388105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).