(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine

C14H19ClFNO3S — CID 124619802

IUPAC(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine
SMILESCCS(=O)(=O)CCN1CCO[C@H](c2ccc(F)cc2Cl)C1
InChIInChI=1S/C14H19ClFNO3S/c1-2-21(18,19)8-6-17-5-7-20-14(10-17)12-4-3-11(16)9-13(12)15/h3-4,9,14H,2,5-8,10H2,1H3/t14-/m0/s1
InChIKeyDXKLODDQWXWDIJ-AWEZNQCLSA-N
MW335.83 g/mol
LogP2.29
Rot. Bonds5

About (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine

(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine (PubChem CID 124619802) has the molecular formula C14H19ClFNO3S and a molecular weight of 335.83 g/mol. Its IUPAC name is (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine.

Molecular Properties

Compound Name(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine
PubChem CID124619802
Molecular FormulaC14H19ClFNO3S
Molecular Weight335.83 g/mol
Exact Mass335.08
IUPAC Name(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine
SMILESCCS(=O)(=O)CCN1CCO[C@H](c2ccc(F)cc2Cl)C1
InChIInChI=1S/C14H19ClFNO3S/c1-2-21(18,19)8-6-17-5-7-20-14(10-17)12-4-3-11(16)9-13(12)15/h3-4,9,14H,2,5-8,10H2,1H3/t14-/m0/s1
InChIKeyDXKLODDQWXWDIJ-AWEZNQCLSA-N
XLogP2.29
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.83
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[2-(2-chloro-4-fluorophenyl)morpholin-4-yl]methyl]furan-3-carboxylic acid
CID 154746798
(2R)-2-(2-chloro-4-fluorophenyl)-4-(1,3-thiazol-4-ylmethyl)morpholine
CID 124619828
(2S)-2-(2-chloro-4-fluorophenyl)-4-(thiadiazol-4-ylmethyl)morpholine
CID 124619492
2-(2-chloro-4-fluorophenyl)-4-(oxolan-3-ylsulfonyl)morpholine
CID 138043834
2-[[(2S)-2-(2-chloro-4-fluorophenyl)morpholin-4-yl]methyl]pyrimidin-4-amine
CID 124619849
5-[[2-(2-chloro-4-fluorophenyl)morpholin-4-yl]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120904693
(2R)-2-(2-chloro-4-fluorophenyl)-4-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine
CID 124619834
2-(2,4-dimethylphenyl)-4-(2-propan-2-ylsulfonylethyl)morpholine
CID 71977182
2-[2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]ethanol;hydrochloride
CID 141261156
4-[(2R)-2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]butan-1-ol
CID 95339618
2-[2-(2-chloro-4-fluorophenyl)morpholin-4-yl]-3-methyl-6-pyridin-4-ylpyrimidin-4-one
CID 59794037
N-[(2-chloro-5-fluorophenyl)-(4-propylmorpholin-2-yl)methyl]ethanamine
CID 105395250

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine?
The IUPAC name of (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine (CID 124619802) is (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine.
What is the SMILES notation for (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine?
The canonical SMILES for (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine is CCS(=O)(=O)CCN1CCO[C@H](c2ccc(F)cc2Cl)C1.
What is the InChIKey of (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine?
The InChIKey is DXKLODDQWXWDIJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H19ClFNO3S/c1-2-21(18,19)8-6-17-5-7-20-14(10-17)12-4-3-11(16)9-13(12)15/h3-4,9,14H,2,5-8,10H2,1H3/t14-/m0/s1.
What are the key properties of (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine?
(2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine has a molecular weight of 335.83 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chloro-4-fluorophenyl)-4-(2-ethylsulfonylethyl)morpholine is sourced from PubChem (CID 124619802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).