2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine

C19H22FNO4S — CID 110326817

IUPAC2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine
SMILESCC(C)Oc1ccc(S(=O)(=O)N2CCOC(c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C19H22FNO4S/c1-14(2)25-17-7-9-18(10-8-17)26(22,23)21-11-12-24-19(13-21)15-3-5-16(20)6-4-15/h3-10,14,19H,11-13H2,1-2H3
InChIKeyCSWZLLLJNRTYEJ-UHFFFAOYSA-N
MW379.45 g/mol
LogP3.38
Rot. Bonds5

About 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine

2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine (PubChem CID 110326817) has the molecular formula C19H22FNO4S and a molecular weight of 379.45 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine
PubChem CID110326817
Molecular FormulaC19H22FNO4S
Molecular Weight379.45 g/mol
Exact Mass379.13
IUPAC Name2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine
SMILESCC(C)Oc1ccc(S(=O)(=O)N2CCOC(c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C19H22FNO4S/c1-14(2)25-17-7-9-18(10-8-17)26(22,23)21-11-12-24-19(13-21)15-3-5-16(20)6-4-15/h3-10,14,19H,11-13H2,1-2H3
InChIKeyCSWZLLLJNRTYEJ-UHFFFAOYSA-N
XLogP3.38
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.45
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[2-(4-fluorophenyl)morpholin-4-yl]sulfonylphenyl]ethanone
CID 42949946
2-(4-methoxyphenyl)-4-(4-propan-2-ylphenyl)sulfonylmorpholine
CID 110327247
2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567
4-(1,3-benzodioxol-5-ylsulfonyl)-2-(4-fluorophenyl)morpholine
CID 110326793
4-(4-ethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327245
1-[4-[2-(4-fluorophenyl)morpholin-4-yl]sulfonylphenyl]pyrrolidin-2-one
CID 42949954
4-(2,5-dimethoxyphenyl)sulfonyl-2-(4-fluorophenyl)morpholine
CID 110326792
4-(4-fluorophenyl)sulfonyl-2-methylmorpholine
CID 43388105
4-(3,4-dimethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327242
4-(4-bromophenyl)sulfonyl-2-(4-methylphenyl)morpholine
CID 110326570
1-(4-fluorophenyl)sulfonyl-3-(4-methoxyphenyl)pyrrolidine
CID 121084236
1-(4-fluorophenyl)sulfonyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide
CID 133168255

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine?
The IUPAC name of 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine (CID 110326817) is 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine.
What is the SMILES notation for 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine?
The canonical SMILES for 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine is CC(C)Oc1ccc(S(=O)(=O)N2CCOC(c3ccc(F)cc3)C2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine?
The InChIKey is CSWZLLLJNRTYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO4S/c1-14(2)25-17-7-9-18(10-8-17)26(22,23)21-11-12-24-19(13-21)15-3-5-16(20)6-4-15/h3-10,14,19H,11-13H2,1-2H3.
What are the key properties of 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine?
2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine has a molecular weight of 379.45 g/mol, XLogP of 3.38, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-(4-propan-2-yloxyphenyl)sulfonylmorpholine is sourced from PubChem (CID 110326817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).