2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine

C19H22FNO4S — CID 110609355

IUPAC2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine
SMILESCOc1cccc(CCS(=O)(=O)N2CCOC(c3ccccc3F)C2)c1
InChIInChI=1S/C19H22FNO4S/c1-24-16-6-4-5-15(13-16)9-12-26(22,23)21-10-11-25-19(14-21)17-7-2-3-8-18(17)20/h2-8,13,19H,9-12,14H2,1H3
InChIKeyIEIQEACSMMHWRJ-UHFFFAOYSA-N
MW379.45 g/mol
LogP2.78
Rot. Bonds6

About 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine

2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine (PubChem CID 110609355) has the molecular formula C19H22FNO4S and a molecular weight of 379.45 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine
PubChem CID110609355
Molecular FormulaC19H22FNO4S
Molecular Weight379.45 g/mol
Exact Mass379.13
IUPAC Name2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine
SMILESCOc1cccc(CCS(=O)(=O)N2CCOC(c3ccccc3F)C2)c1
InChIInChI=1S/C19H22FNO4S/c1-24-16-6-4-5-15(13-16)9-12-26(22,23)21-10-11-25-19(14-21)17-7-2-3-8-18(17)20/h2-8,13,19H,9-12,14H2,1H3
InChIKeyIEIQEACSMMHWRJ-UHFFFAOYSA-N
XLogP2.78
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.45
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-butylsulfonyl-2-(2-fluorophenyl)morpholine
CID 110326692
2-[2-(3-methoxyphenyl)ethylsulfonyl]-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline
CID 110629450
2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine
CID 110326724
4-[2-(4-methoxyphenyl)ethylsulfonyl]-2-(4-methylphenyl)morpholine
CID 121134912
(2S)-2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-4-(2-pyridin-4-ylethylsulfonyl)morpholine
CID 92600457
3-(3-methoxyphenyl)-1-[2-(2-methylphenyl)morpholin-4-yl]propan-1-one
CID 110364528
2-(3,5-dichlorophenyl)-4-(2-phenylethylsulfonyl)morpholine
CID 121134610
2-(3-chlorophenyl)-4-[2-(2-fluorophenyl)ethylsulfonyl]morpholine
CID 110356630
(2R)-2-methyl-4-(2-phenylethylsulfonyl)morpholine
CID 51710241
4-[(4-methoxyphenyl)methylsulfonyl]-2-phenylmorpholine
CID 16895307
2-(4-fluorophenyl)-4-(3-phenylpropylsulfonyl)morpholine
CID 110326810
2-benzyl-4-(2-phenylethylsulfonyl)morpholine
CID 110643972

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine?
The IUPAC name of 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine (CID 110609355) is 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine.
What is the SMILES notation for 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine?
The canonical SMILES for 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine is COc1cccc(CCS(=O)(=O)N2CCOC(c3ccccc3F)C2)c1.
What is the InChIKey of 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine?
The InChIKey is IEIQEACSMMHWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO4S/c1-24-16-6-4-5-15(13-16)9-12-26(22,23)21-10-11-25-19(14-21)17-7-2-3-8-18(17)20/h2-8,13,19H,9-12,14H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine?
2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine has a molecular weight of 379.45 g/mol, XLogP of 2.78, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine is sourced from PubChem (CID 110609355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).