(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine

C16H20N2O3S — CID 129403722

IUPAC(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine
SMILESCOc1ccccc1OCCN1CCO[C@H](c2nccs2)C1
InChIInChI=1S/C16H20N2O3S/c1-19-13-4-2-3-5-14(13)20-9-7-18-8-10-21-15(12-18)16-17-6-11-22-16/h2-6,11,15H,7-10,12H2,1H3/t15-/m0/s1
InChIKeyFIFZWSKSSYNTJG-HNNXBMFYSA-N
MW320.41 g/mol
LogP2.60
Rot. Bonds6

About (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine

(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine (PubChem CID 129403722) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine.

Molecular Properties

Compound Name(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine
PubChem CID129403722
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC Name(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine
SMILESCOc1ccccc1OCCN1CCO[C@H](c2nccs2)C1
InChIInChI=1S/C16H20N2O3S/c1-19-13-4-2-3-5-14(13)20-9-7-18-8-10-21-15(12-18)16-17-6-11-22-16/h2-6,11,15H,7-10,12H2,1H3/t15-/m0/s1
InChIKeyFIFZWSKSSYNTJG-HNNXBMFYSA-N
XLogP2.60
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-(2-methoxyphenoxy)ethyl]-2-methylmorpholine
CID 47053041
1-[(2R)-4-[2-(2-methoxyphenoxy)ethyl]morpholin-2-yl]-N,N-dimethylmethanamine
CID 95347452
4-[(1-methylimidazol-2-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine
CID 86775020
2-[5-[2-(2-methoxyphenoxy)ethyl]-1-methylpyrazol-3-yl]-4-(2-phenylethyl)morpholine
CID 155983871
(2S)-4-[(5-methylpyrazin-2-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine
CID 95156937
4-[2-(2-methoxy-4-methylphenoxy)ethyl]-2-(1-methyltetrazol-5-yl)morpholine
CID 162629473
(2R)-4-[2-(4-nitrophenyl)ethyl]-2-(1,3-thiazol-2-yl)morpholine
CID 124628866
(2S)-2-(5-methyl-1,2,4-oxadiazol-3-yl)-4-[2-(2-methylphenoxy)ethyl]morpholine
CID 97316172
(2R)-4-[(6-fluoroquinolin-8-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine
CID 95156923
(2R)-4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine
CID 97158597
1-methyl-6-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]-3,4-dihydroquinolin-2-one
CID 124619007
2-(2-methoxyphenoxy)-1-[4-(1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 110289796

Frequently Asked Questions

What is the IUPAC name of (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine?
The IUPAC name of (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine (CID 129403722) is (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine.
What is the SMILES notation for (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine?
The canonical SMILES for (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine is COc1ccccc1OCCN1CCO[C@H](c2nccs2)C1.
What is the InChIKey of (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine?
The InChIKey is FIFZWSKSSYNTJG-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-19-13-4-2-3-5-14(13)20-9-7-18-8-10-21-15(12-18)16-17-6-11-22-16/h2-6,11,15H,7-10,12H2,1H3/t15-/m0/s1.
What are the key properties of (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine?
(2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine has a molecular weight of 320.41 g/mol, XLogP of 2.60, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-[2-(2-methoxyphenoxy)ethyl]-2-(1,3-thiazol-2-yl)morpholine is sourced from PubChem (CID 129403722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).