(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine

C19H22FNO2S — CID 95783521

IUPAC(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine
SMILESCSc1ccc(OCCN2CCO[C@@H](c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C19H22FNO2S/c1-24-18-8-6-17(7-9-18)22-12-10-21-11-13-23-19(14-21)15-2-4-16(20)5-3-15/h2-9,19H,10-14H2,1H3/t19-/m1/s1
InChIKeyXWPZTIYBBMKGNB-LJQANCHMSA-N
MW347.46 g/mol
LogP4.00
Rot. Bonds6

About (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine

(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine (PubChem CID 95783521) has the molecular formula C19H22FNO2S and a molecular weight of 347.46 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine
PubChem CID95783521
Molecular FormulaC19H22FNO2S
Molecular Weight347.46 g/mol
Exact Mass347.14
IUPAC Name(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine
SMILESCSc1ccc(OCCN2CCO[C@@H](c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C19H22FNO2S/c1-24-18-8-6-17(7-9-18)22-12-10-21-11-13-23-19(14-21)15-2-4-16(20)5-3-15/h2-9,19H,10-14H2,1H3/t19-/m1/s1
InChIKeyXWPZTIYBBMKGNB-LJQANCHMSA-N
XLogP4.00
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(4-butoxyphenyl)morpholin-4-yl]ethanol;hydrochloride
CID 141298267
2-(4-ethoxyphenyl)sulfanyl-1-[2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 55564198
(2R)-2-(4-fluorophenyl)-4-methylmorpholine
CID 67355003
3-[(2S)-2-(4-heptoxyphenyl)morpholin-4-yl]propanoic acid
CID 124564158
2-(3-bromophenyl)-4-[2-(3-fluorophenoxy)ethyl]morpholine
CID 60609509
3-[(2R)-2-[4-(5-oxohexoxy)phenyl]morpholin-4-yl]propanoic acid
CID 124564116
3-[(2R)-2-(4-heptoxyphenyl)morpholin-4-yl]propanoic acid
CID 124564157
ethyl 5-[2-(4-fluorophenyl)morpholin-4-yl]pentanoate
CID 56875309
2-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethyl]isoindole-1,3-dione
CID 36737030
(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine
CID 888238
2-(4-fluorophenoxy)-N-[4-(4-methylmorpholin-2-yl)phenyl]acetamide
CID 110720390
4-[2-[2-(4-methyl-1,2,4-triazol-3-yl)morpholin-4-yl]ethoxy]benzonitrile
CID 128997059

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine?
The IUPAC name of (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine (CID 95783521) is (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine is CSc1ccc(OCCN2CCO[C@@H](c3ccc(F)cc3)C2)cc1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine?
The InChIKey is XWPZTIYBBMKGNB-LJQANCHMSA-N. The full InChI is InChI=1S/C19H22FNO2S/c1-24-18-8-6-17(7-9-18)22-12-10-21-11-13-23-19(14-21)15-2-4-16(20)5-3-15/h2-9,19H,10-14H2,1H3/t19-/m1/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine?
(2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine has a molecular weight of 347.46 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-4-[2-(4-methylsulfanylphenoxy)ethyl]morpholine is sourced from PubChem (CID 95783521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).